Home Aminos Carbamic acid, N-[(2S)-2-amino-3-phenylpropyl]-, 1,1-dimethylethyl ester

Carbamic acid, N-[(2S)-2-amino-3-phenylpropyl]-, 1,1-dimethylethyl ester

CAS No.:
167298-44-4
Catalog Number:
AG001X92
Molecular Formula:
C14H22N2O2
Molecular Weight:
250.3367
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Product Description
Catalog Number:
AG001X92
Chemical Name:
Carbamic acid, N-[(2S)-2-amino-3-phenylpropyl]-, 1,1-dimethylethyl ester
CAS Number:
167298-44-4
Molecular Formula:
C14H22N2O2
Molecular Weight:
250.3367
MDL Number:
MFCD06245566
IUPAC Name:
tert-butyl N-[(2S)-2-amino-3-phenylpropyl]carbamate
InChI:
InChI=1S/C14H22N2O2/c1-14(2,3)18-13(17)16-10-12(15)9-11-7-5-4-6-8-11/h4-8,12H,9-10,15H2,1-3H3,(H,16,17)/t12-/m0/s1
InChI Key:
ADVSLLRGGNVROC-LBPRGKRZSA-N
SMILES:
N[C@@H](Cc1ccccc1)CNC(=O)OC(C)(C)C
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
250.168g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.342g/mol
Monoisotopic Mass:
250.168g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties