Home Other Building Blocks 4-Hexylbenzoyl chloride

4-Hexylbenzoyl chloride

CAS No.:
50606-95-6
Catalog Number:
AG003LU3
Molecular Formula:
C13H17ClO
Molecular Weight:
224.7265
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Product Description
Catalog Number:
AG003LU3
Chemical Name:
4-Hexylbenzoyl chloride
CAS Number:
50606-95-6
Molecular Formula:
C13H17ClO
Molecular Weight:
224.7265
MDL Number:
MFCD00000701
IUPAC Name:
4-hexylbenzoyl chloride
InChI:
InChI=1S/C13H17ClO/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3
InChI Key:
XRAHLPNMIIAEPP-UHFFFAOYSA-N
SMILES:
CCCCCCc1ccc(cc1)C(=O)Cl
EC Number:
256-647-6
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.097g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.728g/mol
Monoisotopic Mass:
224.097g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties