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(1-allyl-1H-benzimidazol-2-yl)methanol - 98%, high purity , CAS No.300706-95-0

COA

Grade & Purity:

≥98%

Cas Number: 300706-95-0
Molecular Weight: 188.23
PubChem CID: 718196
PubChem SID: 504759971

In stock

Item Number

A354045

Grouped product items
SKU	Size	Availability	Price
A354045-50mg	50mg	3	$130.90
A354045-250mg	250mg	3	$429.90
A354045-1g	1g	2	$1,132.90

Basic Description

Synonyms	(1-ALLYL-1H-1,3-BENZIMIDAZOL-2-YL)METHANOL \| EN300-40330 \| WCFBNPLGHKARRT-UHFFFAOYSA-N \| J-017760 \| [1-(prop-2-en-1-yl)-1H-1,3-benzodiazol-2-yl]methanol \| SCHEMBL1520132 \| IFLab1_001526 \| Z57299956 \| AE-848/02271002 \| HMS1416F08 \| DTXSID70352083 \| (1-Ally
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzimidazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzimidazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzimidazoles
Alternative Parents	N-substituted imidazoles Benzenoids Heteroaromatic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzimidazole - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Azacycle - Organopnictogen compound - Aromatic alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
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

Pubchem Sid	504759971
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504759971
IUPAC Name	(1-prop-2-enylbenzimidazol-2-yl)methanol
INCHI	InChI=1S/C11H12N2O/c1-2-7-13-10-6-4-3-5-9(10)12-11(13)8-14/h2-6,14H,1,7-8H2
InChIKey	WCFBNPLGHKARRT-UHFFFAOYSA-N
Smiles	C=CCN1C2=CC=CC=C2N=C1CO
Isomeric SMILES	C=CCN1C2=CC=CC=C2N=C1CO
Molecular Weight	188.23
Reaxy-Rn	7637335
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7637335&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
C2226355	Certificate of Analysis	Jan 06, 2025	A354045
C2226387	Certificate of Analysis	Jan 06, 2025	A354045
C2226402	Certificate of Analysis	Jan 06, 2025	A354045

Chemical and Physical Properties

Molecular Weight	188.230 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	188.095 Da
Monoisotopic Mass	188.095 Da
Topological Polar Surface Area	38.100 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	207.000
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

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