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218608-93-6

218608-93-6 | (R)-N-Boc-3-Amino-4-(2-chlorophenyl)butanoic acid

CAS No: 218608-93-6 Catalog No: AG00385V MDL No:MFCD01076274

Product Description

Catalog Number:
AG00385V
Chemical Name:
(R)-N-Boc-3-Amino-4-(2-chlorophenyl)butanoic acid
CAS Number:
218608-93-6
Molecular Formula:
C15H20ClNO4
Molecular Weight:
313.7766
MDL Number:
MFCD01076274
IUPAC Name:
(3R)-4-(2-chlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C15H20ClNO4/c1-15(2,3)21-14(20)17-11(9-13(18)19)8-10-6-4-5-7-12(10)16/h4-7,11H,8-9H2,1-3H3,(H,17,20)(H,18,19)/t11-/m1/s1
InChI Key:
UBRPCCFLMVZEKN-LLVKDONJSA-N
SMILES:
OC(=O)C[C@@H](Cc1ccccc1Cl)NC(=O)OC(C)(C)C

Properties

Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
313.108g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
313.778g/mol
Monoisotopic Mass:
313.108g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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