Home Bromides 1020253-13-7
1020253-13-7,MFCD09972172
Catalog No.:AA0006AD
1020253-13-7 | 1-Bromo-4,4-dimethylcyclohex-1-ene
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1g
95%
in stock  
$200.00   $140.00
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5g
95%
in stock  
$921.00   $645.00
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Technical Information
Catalog Number:
AA0006AD
Chemical Name:
1-Bromo-4,4-dimethylcyclohex-1-ene
CAS Number:
1020253-13-7
Molecular Formula:
C8H13Br
Molecular Weight:
189.0928
MDL Number:
MFCD09972172
IUPAC Name:
1-bromo-4,4-dimethylcyclohexene
InChI:
InChI=1S/C8H13Br/c1-8(2)5-3-7(9)4-6-8/h3H,4-6H2,1-2H3
InChI Key:
DHKVINDPKZRTAJ-UHFFFAOYSA-N
SMILES:
BrC1=CCC(CC1)(C)C
Properties
Computed Properties
 
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.02g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.096g/mol
Monoisotopic Mass:
188.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

Synonyms
 
1-BROMO-4,4-DIMETHYLCYCLOHEX-1-ENE 
1020253-13-7 
ZINC63363110 
Cyclohexene, 1-bromo-4,4-dimethyl- 
AKOS006310705 
1-Bromo-4,4-dimethyl cyclohex-1-ene 
RTR-000524 
AJ-114391 
AX8250417 
TR-000524 
FT-0768745 
ST24037880 
1-bromo-4,4-dimethylcyclohexene 
Y3535 
A-4173 
I14-24939 
C8H13Br 
ACMC-2097zg 
SCHEMBL624457 
CTK4A0598 
DTXSID40674345 
DHKVINDPKZRTAJ-UHFFFAOYSA-N 
ANW-14618 
MFCD09972172 
Literature
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