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119740-95-3

119740-95-3 | β-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-, methyl ester

CAS No: 119740-95-3 Catalog No: AG000PL0 MDL No:MFCD12797747

Product Description

Catalog Number:
AG000PL0
Chemical Name:
β-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-, methyl ester
CAS Number:
119740-95-3
Molecular Formula:
C10H19NO4
Molecular Weight:
217.2622
MDL Number:
MFCD12797747
IUPAC Name:
methyl 3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoate
InChI:
InChI=1S/C10H19NO4/c1-10(2,3)15-9(13)11(4)7-6-8(12)14-5/h6-7H2,1-5H3
InChI Key:
QAIYFGAVROBBNI-UHFFFAOYSA-N
SMILES:
COC(=O)CCN(C(=O)OC(C)(C)C)C

Properties

Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.131g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.265g/mol
Monoisotopic Mass:
217.131g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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