Home Other Building Blocks (R)-VerapamilicAcid(S)-α-MethylbenzylamineSalt

(R)-VerapamilicAcid(S)-α-MethylbenzylamineSalt

CAS No.:
302825-76-9
Catalog Number:
AG00C2AV
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C2AV
Chemical Name:
(R)-VerapamilicAcid(S)-α-MethylbenzylamineSalt
CAS Number:
302825-76-9
MDL Number:
MFCD18252467
IUPAC Name:
(4S)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexanoic acid;(1S)-1-phenylethanamine
InChI:
InChI=1S/C16H21NO4.C8H11N/c1-11(2)16(10-17,8-7-15(18)19)12-5-6-13(20-3)14(9-12)21-4;1-7(9)8-5-3-2-4-6-8/h5-6,9,11H,7-8H2,1-4H3,(H,18,19);2-7H,9H2,1H3/t16-;7-/m00/s1
InChI Key:
VNKDXBXOHWCAIP-PIUSWTIESA-N
Properties
Complexity:
475  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
412.236g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
412.53g/mol
Monoisotopic Mass:
412.236g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties