Home Carbonyls 4-benzylpiperidine-1-carbonyl chloride

4-benzylpiperidine-1-carbonyl chloride

CAS No.:
31252-43-4
Catalog Number:
AG01BFLB
Molecular Formula:
C13H16ClNO
Molecular Weight:
237.7252
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Product Description
Catalog Number:
AG01BFLB
Chemical Name:
4-benzylpiperidine-1-carbonyl chloride
CAS Number:
31252-43-4
Molecular Formula:
C13H16ClNO
Molecular Weight:
237.7252
MDL Number:
MFCD19281929
IUPAC Name:
4-benzylpiperidine-1-carbonyl chloride
InChI:
InChI=1S/C13H16ClNO/c14-13(16)15-8-6-12(7-9-15)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChI Key:
LDNVHKQYAWVPKB-UHFFFAOYSA-N
SMILES:
ClC(=O)N1CCC(CC1)Cc1ccccc1
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.092g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.727g/mol
Monoisotopic Mass:
237.092g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties