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2051-99-2 | Benzene, 1-bromo-4-(2-methylpropyl)-
CAS No: 2051-99-2 Catalog No: AG0029VY MDL No:MFCD03425886
Product Description
Catalog Number:
AG0029VY
Chemical Name:
Benzene, 1-bromo-4-(2-methylpropyl)-
CAS Number:
2051-99-2
Molecular Formula:
C10H13Br
Molecular Weight:
213.1142
MDL Number:
MFCD03425886
IUPAC Name:
1-bromo-4-(2-methylpropyl)benzene
InChI:
InChI=1S/C10H13Br/c1-8(2)7-9-3-5-10(11)6-4-9/h3-6,8H,7H2,1-2H3
InChI Key:
BVBHVVRVSMBCPW-UHFFFAOYSA-N
SMILES:
CC(Cc1ccc(cc1)Br)C
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.118g/mol
Monoisotopic Mass:
212.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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