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88999-91-1 | Benzene, 1-bromo-4-(4-bromobutyl)-
CAS No: 88999-91-1 Catalog No: AG0046A8 MDL No:
Product Description
Catalog Number:
AG0046A8
Chemical Name:
Benzene, 1-bromo-4-(4-bromobutyl)-
CAS Number:
88999-91-1
Molecular Formula:
C10H12Br2
Molecular Weight:
292.0103
IUPAC Name:
1-bromo-4-(4-bromobutyl)benzene
InChI:
InChI=1S/C10H12Br2/c11-8-2-1-3-9-4-6-10(12)7-5-9/h4-7H,1-3,8H2
InChI Key:
YWTSERISEGNNBO-UHFFFAOYSA-N
SMILES:
BrCCCCc1ccc(cc1)Br
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.929g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.014g/mol
Monoisotopic Mass:
289.931g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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