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121505-94-0 | Carbamic acid, N-[2-(methoxymethylamino)-2-oxoethyl]-, phenylmethyl ester
CAS No: 121505-94-0 Catalog No: AG00153L MDL No:MFCD09997727
Product Description
Catalog Number:
AG00153L
Chemical Name:
Carbamic acid, N-[2-(methoxymethylamino)-2-oxoethyl]-, phenylmethyl ester
CAS Number:
121505-94-0
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
MDL Number:
MFCD09997727
IUPAC Name:
benzyl N-[2-[methoxy(methyl)amino]-2-oxoethyl]carbamate
InChI:
InChI=1S/C12H16N2O4/c1-14(17-2)11(15)8-13-12(16)18-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,13,16)
InChI Key:
NWYPLKICSHBTAJ-UHFFFAOYSA-N
SMILES:
COCNC(=O)CNC(=O)OCc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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