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13734-31-1

13734-31-1 | N-Boc-N-methyl-DL-alanine

CAS No: 13734-31-1 Catalog No: AG0038AP MDL No:MFCD00153297

Product Description

Catalog Number:
AG0038AP
Chemical Name:
N-Boc-N-methyl-DL-alanine
CAS Number:
13734-31-1
Molecular Formula:
C9H17NO4
Molecular Weight:
203.2356
MDL Number:
MFCD00153297
IUPAC Name:
2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
InChI:
InChI=1S/C9H17NO4/c1-6(7(11)12)10(5)8(13)14-9(2,3)4/h6H,1-5H3,(H,11,12)
InChI Key:
VLHQXRIIQSTJCQ-UHFFFAOYSA-N
SMILES:
CC(N(C(=O)OC(C)(C)C)C)C(=O)O

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.238g/mol
Monoisotopic Mass:
203.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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