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1647-26-3 | Cyclohexane, (2-bromoethyl)-
CAS No: 1647-26-3 Catalog No: AG001V23 MDL No:MFCD00019398
Product Description
Catalog Number:
AG001V23
Chemical Name:
Cyclohexane, (2-bromoethyl)-
CAS Number:
1647-26-3
Molecular Formula:
C8H15Br
Molecular Weight:
191.1087
MDL Number:
MFCD00019398
IUPAC Name:
2-bromoethylcyclohexane
InChI:
InChI=1S/C8H15Br/c9-7-6-8-4-2-1-3-5-8/h8H,1-7H2
InChI Key:
JRQAAYVLPPGEHT-UHFFFAOYSA-N
SMILES:
BrCCC1CCCCC1
EC Number:
216-712-1
Properties
Complexity:
65
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.036g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.112g/mol
Monoisotopic Mass:
190.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| Identification of volatile organic compounds in flowers of Astragalus lagopoides. | Natural product research 20120101 |
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