Home Aminos (S)-1-Benzyl 5-tert-butyl 2-aminopentanedioate hydrochloride

(S)-1-Benzyl 5-tert-butyl 2-aminopentanedioate hydrochloride

CAS No.:
98102-32-0
Catalog Number:
AG00IK15
Molecular Formula:
C16H24ClNO4
Molecular Weight:
329.8191
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Product Description
Catalog Number:
AG00IK15
Chemical Name:
(S)-1-Benzyl 5-tert-butyl 2-aminopentanedioate hydrochloride
CAS Number:
98102-32-0
Molecular Formula:
C16H24ClNO4
Molecular Weight:
329.8191
MDL Number:
MFCD16036702
IUPAC Name:
1-O-benzyl 5-O-tert-butyl (2S)-2-aminopentanedioate;hydrochloride
InChI:
InChI=1S/C16H23NO4.ClH/c1-16(2,3)21-14(18)10-9-13(17)15(19)20-11-12-7-5-4-6-8-12;/h4-8,13H,9-11,17H2,1-3H3;1H/t13-;/m0./s1
InChI Key:
PZCDXXIAXZLMQY-ZOWNYOTGSA-N
SMILES:
O=C(OC(C)(C)C)CC[C@@H](C(=O)OCc1ccccc1)N.Cl
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
329.139g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
329.821g/mol
Monoisotopic Mass:
329.139g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties