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87625-07-8

87625-07-8 | Benzene, 1-bromo-4-(4-methyl-1-cyclohexen-1-yl)-

CAS No: 87625-07-8 Catalog No: AG004HW7 MDL No:

Product Description

Catalog Number:
AG004HW7
Chemical Name:
Benzene, 1-bromo-4-(4-methyl-1-cyclohexen-1-yl)-
CAS Number:
87625-07-8
Molecular Formula:
C13H15Br
Molecular Weight:
251.1622
IUPAC Name:
1-bromo-4-(4-methylcyclohexen-1-yl)benzene
InChI:
InChI=1S/C13H15Br/c1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12/h4,6-10H,2-3,5H2,1H3
InChI Key:
KSHPGUFWKCLIST-UHFFFAOYSA-N
SMILES:
CC1CCC(=CC1)c1ccc(cc1)Br

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.036g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.167g/mol
Monoisotopic Mass:
250.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

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