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123876-53-9 | Benzoyl chloride, 4-(3-bromopropyl)-
CAS No: 123876-53-9 Catalog No: AG000L79 MDL No:
Product Description
Catalog Number:
AG000L79
Chemical Name:
Benzoyl chloride, 4-(3-bromopropyl)-
CAS Number:
123876-53-9
Molecular Formula:
C10H10BrClO
Molecular Weight:
261.5428
IUPAC Name:
4-(3-bromopropyl)benzoyl chloride
InChI:
InChI=1S/C10H10BrClO/c11-7-1-2-8-3-5-9(6-4-8)10(12)13/h3-6H,1-2,7H2
InChI Key:
YGCGJAZXGLNVCY-UHFFFAOYSA-N
SMILES:
BrCCCc1ccc(cc1)C(=O)Cl
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.543g/mol
Monoisotopic Mass:
259.96g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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