Home Other Building Blocks (S)-3-Methyl-2-phenylbutylamine

(S)-3-Methyl-2-phenylbutylamine

CAS No.:
106498-32-2
Catalog Number:
AG0032H4
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
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Product Description
Catalog Number:
AG0032H4
Chemical Name:
(S)-3-Methyl-2-phenylbutylamine
CAS Number:
106498-32-2
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
MDL Number:
MFCD16620484
IUPAC Name:
(2S)-3-methyl-2-phenylbutan-1-amine
InChI:
InChI=1S/C11H17N/c1-9(2)11(8-12)10-6-4-3-5-7-10/h3-7,9,11H,8,12H2,1-2H3/t11-/m0/s1
InChI Key:
VDMAQVANUGNDOM-NSHDSACASA-N
SMILES:
NC[C@H](c1ccccc1)C(C)C
Properties
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
163.136g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.264g/mol
Monoisotopic Mass:
163.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties