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(S)-(-)-Verapamilic Acid

CAS No.:
36622-24-9
Catalog Number:
AG00C946
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C946
Chemical Name:
(S)-(-)-Verapamilic Acid
CAS Number:
36622-24-9
MDL Number:
MFCD12031364
IUPAC Name:
(4S)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexanoic acid
InChI:
InChI=1S/C16H21NO4/c1-11(2)16(10-17,8-7-15(18)19)12-5-6-13(20-3)14(9-12)21-4/h5-6,9,11H,7-8H2,1-4H3,(H,18,19)/t16-/m0/s1
InChI Key:
BSHCLIANLKRGLY-INIZCTEOSA-N
Properties
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
291.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
291.347g/mol
Monoisotopic Mass:
291.147g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
79.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties