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3-(Bromomethyl)cyclohexene

HCID 36936
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
34825-93-9
Standard SMILES
BrCC1C=CCCC1
InChIKey
NRDIHSPUUCHBQG-UHFFFAOYSA-N
Molecular formula
C7H11Br
Average molar mass
175.07 g/mol
Monoisotopic mass
174.00441

Names & identifiers

Preferred name
3-(Bromomethyl)cyclohexene
IUPAC
3-(bromomethyl)cyclohexene
English name
3-(Bromomethyl)cyclohexene
Molecular formula
C7H11Br
Molecular weight
175.07

Names & synonyms

34825-93-93-(BROMOMETHYL)CYCLOHEXENEDTXSID20858808RefChem:1067008DTXCID408095543-(bromomethyl)cyclohex-1-eneCyclohexene, 3-(bromomethyl)-3-bromomethylcyclohexeneSCHEMBL17578910NRDIHSPUUCHBQG-UHFFFAOYSA-N3-(Bromomethyl)-1-cyclohexene #JBA82593
Show more names
3-Bromomethyl-1-cyclohexene3-(Bromomethyl)-1-cyclohexene
MFCD20621480SY522627G50194EN300-1717289

Database identifiers

CAS
34825-93-9
PubChem CID
36936
DTXSID
DTXSID20858808
EC Number
155-221-6
Nikkaji
J109.055K

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
8
Formal charge
0
Complexity
86.4

Physicochemical properties

Boiling point
74 · 74-75 °C(Press: 13 Torr)
Density
1.306 · 1.306±0.06 g/cm3(Predicted)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (100%)

Chemistry & industry

Upstream & downstream products

Downstream products

Cycloheptyl bromide

Suppliers1 total

宝欧信特生物科技(苏州)有限公司51288865780 · [email protected]

Related reactions

0 records
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes