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2-Bromobicyclo[2.2.1]heptane - 97%, high purity , CAS No.29342-65-2

COA

Grade & Purity:

≥97%

Cas Number: 29342-65-2
Molecular Weight: 175.07
EC Number: ‘219-798-9
PubChem CID: 98232

In stock

Item Number

B588611

Grouped product items
SKU	Size	Availability	Price
B588611-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$26.90
B588611-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$117.90
B588611-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$525.90

Basic Description

Synonyms	SCHEMBL1358243 \| Bicyclo[2.2.1]heptane, 2-bromo-, exo- \| D84065 \| BS-16882 \| exo-2-Bromobicyclo[2.2.1]heptane \| NSC 91496 \| SY316323 \| 2-Bromobicyclo[2.2.1]heptane \| AMY19483 \| exo-Norbornyl bromide \| Norbornane, 2-bromo-, exo- \| Bicyclo[2.2.1]heptane, 2-
Specifications & Purity	≥97%
Storage Temp	Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Prenol lipids
    - Subclass Monoterpenoids

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Prenol lipids
Subclass	Monoterpenoids
Intermediate Tree Nodes	Not available
Direct Parent	Bicyclic monoterpenoids
Alternative Parents	Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Bicyclic monoterpenoid - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
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	2-bromobicyclo[2.2.1]heptane
INCHI	InChI=1S/C7H11Br/c8-7-4-5-1-2-6(7)3-5/h5-7H,1-4H2
InChIKey	QXYOAWHKJRWNID-UHFFFAOYSA-N
Smiles	C1CC2CC1CC2Br
Isomeric SMILES	C1CC2CC1CC2Br
Molecular Weight	175.07
Reaxy-Rn	2036621
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2036621&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	175.070 g/mol
XLogP3	2.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	174.004 Da
Monoisotopic Mass	174.004 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	101.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
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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