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Cyclopentyl Isocyanate - >98.0%(GC), high purity , CAS No.4747-71-1

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Cyclopentyl Isocyanate - >98.0%(GC), high purity , CAS No.4747-71-1

13 Citations

COA

Grade & Purity:

≥98%(GC)

Cas Number: 4747-71-1
Molecular Weight: 111.14
MDL number: MFCD02093695
PubChem CID: 643500

In stock

Item Number

C153263

Grouped product items
SKU	Size	Availability	Price
C153263-1g	1g	2	$19.90
C153263-5g	5g	2	$56.90
C153263-25g	25g	1	$252.90
C153263-100g	100g	1	$908.90

View related series

Five membered carbocyclic compound (162) Nitrogenous compounds (2445)

Basic Description

Synonyms	BB 0259968 \| isocyanato cyclopentane \| SCHEMBL6196 \| Cyclopentylisocyanate \| AKOS000185060 \| CZALJDQHONFVFU-UHFFFAOYSA-N \| DTXSID20349201 \| EN300-54825 \| BBL036935 \| FT-0635426 \| isocyanatocyclopentane \| isocyanato-cyclopentane \| STK500758 \| Z316172554 \|
Specifications & Purity	≥98%(GC)
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Isocyanates

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Isocyanates
Intermediate Tree Nodes	Not available
Direct Parent	Isocyanates
Alternative Parents	Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Isocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as isocyanates. These are organic compounds containing the isocyanic acid tautomer, HN=C=O, of cyanic acid, HOC#N or its hydrocarbyl derivatives RN=C=O.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	isocyanatocyclopentane
INCHI	InChI=1S/C6H9NO/c8-5-7-6-3-1-2-4-6/h6H,1-4H2
InChIKey	CZALJDQHONFVFU-UHFFFAOYSA-N
Smiles	C1CCC(C1)N=C=O
Isomeric SMILES	C1CCC(C1)N=C=O
WGK Germany	3
Molecular Weight	111.14
Reaxy-Rn	2075400
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2075400&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot Number	Certificate Type	Date	Item
I2107380	Certificate of Analysis	Jun 10, 2025	C153263
I2107381	Certificate of Analysis	Jun 10, 2025	C153263
I2107383	Certificate of Analysis	Jun 10, 2025	C153263
K2230355	Certificate of Analysis	Aug 15, 2022	C153263
L2418434	Certificate of Analysis	Aug 15, 2022	C153263
K2230277	Certificate of Analysis	Aug 15, 2022	C153263
K2230356	Certificate of Analysis	Aug 15, 2022	C153263
K2230369	Certificate of Analysis	Aug 15, 2022	C153263
L2418433	Certificate of Analysis	Apr 21, 2021	C153263

Chemical and Physical Properties

Sensitivity	heat&Moisture sensitive.
Refractive Index	n20/D 1.447 (lit.)
Flash Point(°F)	96.8 °F
Flash Point(°C)	36°C(lit.)
Boil Point(°C)	146°C(lit.)
Molecular Weight	111.140 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	111.068 Da
Monoisotopic Mass	111.068 Da
Topological Polar Surface Area	29.400 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	110.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Yuqi Wang, Ying Zhang, Yuna Li, Luyao Ma, Zhiguang Niu. (2023) Partitioning behavior and mechanism of polyhalogenated carbazoles in water and suspended particulate matter. SCIENCE OF THE TOTAL ENVIRONMENT, 891 (164590).
2. Li Zhiwei, An Dong, He Rizheng, Sun Zhijian, Li Jiaxiong, Zhang Zhiyi, Liu Yaqing, Wong Chingping. (2023) The design of crosslinks in different vulcanized systems to improve crack growth resistance for carbon black/graphene oxide/natural rubber composites. Advanced Composites and Hybrid Materials, 6 (2): (1-12).
3. Yu Zhou, Yu-Ting Huang, Gui-Xiang Liu, Shuangquan Liao, Ming-Chao Luo. (2022) Generic Recycling Strategy to Improve Robustness of Recycled Rubbers through Bioinspired Multiphase Network. ACS Sustainable Chemistry & Engineering, 10 (46): (15328–15334).
4. Luxiang Zhu, Zhuyu Sun, Jin Wen, Xiang Wang, Yanan Liu, Xiaoxiang Zhao, Yanbiao Liu. (2022) Quantitative structure-activity relationship study on the degradation of polyhalogenated carbazoles by sulfidated zero-valent iron/peroxymonosulfate system. Journal of Environmental Chemical Engineering, 10 (107244).
5. Hou Feng-Yi, Song Yi-Hu, Zheng Qiang. (2021) Influence of Liquid Isoprene Rubber on Strain Softening of Carbon Black Filled Isoprene Rubber Nanocomposites. CHINESE JOURNAL OF POLYMER SCIENCE, 39 (7): (887-895).
6. Gaopan Liu, Ningbo Xu, Yue Zou, Ke Zhou, Xuerui Yang, Tianpeng Jiao, Wu Yang, Yong Yang, Jianming Zheng. (2021) Stabilizing Ni-Rich LiNi0.83Co0.12Mn0.05O2 with Cyclopentyl Isocyanate as a Novel Electrolyte Additive. ACS Applied Materials & Interfaces, 13 (10): (12069–12078).
7. Chen Chengjian, Chi Zhenguo, Chong Kok Chan, Batsanov Andrei S., Yang Zhan, Mao Zhu, Yang Zhiyong, Liu Bin. (2020) Carbazole isomers induce ultralong organic phosphorescence. NATURE MATERIALS, 20 (2): (175-180).
8. Dongfang Li, Shang Ma, Abdelatif Laroui, Yixian Zhang, Jie Wang, Ping Lu, Jian Dong. (2020) Controlling water dynamics for kinetic inhibition of clathrate hydrate. FUEL, 271 (117588).
9. Jiao Chen, Ye Sha, Siyang Gao, Chao Teng, Xiaoliang Wang, Dongshan Zhou, Linling Li, Wei Chen, Gi Xue. (2017) Associated inter- and intrachain conformational transitions in polystyrene solutions. JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS, 55 (18): (1373-1379).
10. Xiaohe Miao, Xiaoyuan Duan, Huatao Cheng, Haoyu Duan, Zhiyi Zhang, Yaqing Liu, Shuaishuai Cheng. (2024) Green and energy-saving tread rubber by constructing chemical cross-linking interface between graphene oxide and natural rubber. COMPOSITES COMMUNICATIONS, 51 (102067).
11. Dongqin Lei, Jing Xin, Fen Qin, Hongyi Lan, Jing Liu, Sijia Wang, Jing Wang, Weihui Zeng, Cuiping Yao. (2024) Soluble hyaluronic acid microneedle arrays mediated RGD-modified liposome delivery for pain relief during photodynamic therapy by blocking TRPV1. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 282 (136952).
12. Jiawei Yang, Feifei Wang, Chaobo Liang, Shaofeng Zhou, Jin Huang, Guizhe Zhao, Yaqing Liu. (2024) Surface one-step modification of graphene oxide with N-cyclohexylbenzothiazole-2-sulfonamide to enhance the wear resistance of natural rubber/butadiene rubber composites. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 703 (135314).
13. Shujuan Yu, Xiang Deng, Cailong Deng, Jing Xia, Qilong Li. (2024) Synthesis of Novel Broad-Spectrum Chitosan Polymer Carbon Dots-Based Ultraviolet Absorbers and Their Application in Natural Rubber. JOURNAL OF APPLIED POLYMER SCIENCE, (e56609).

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