Home Halogens 3-bromo-1,1,5-trimethylcyclohexane

3-bromo-1,1,5-trimethylcyclohexane

CAS No.:
872288-13-6
Catalog Number:
AG01AJBM
Molecular Formula:
C9H17Br
Molecular Weight:
205.1353
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Product Description
Catalog Number:
AG01AJBM
Chemical Name:
3-bromo-1,1,5-trimethylcyclohexane
CAS Number:
872288-13-6
Molecular Formula:
C9H17Br
Molecular Weight:
205.1353
MDL Number:
MFCD11180295
IUPAC Name:
3-bromo-1,1,5-trimethylcyclohexane
InChI:
InChI=1S/C9H17Br/c1-7-4-8(10)6-9(2,3)5-7/h7-8H,4-6H2,1-3H3
InChI Key:
QAIKVKDKYUBKQY-UHFFFAOYSA-N
SMILES:
CC1CC(Br)CC(C1)(C)C
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.051g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.139g/mol
Monoisotopic Mass:
204.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties