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124676-23-9 | Acetic acid, amino[[(phenylmethoxy)carbonyl]amino]- (9CI)
CAS No: 124676-23-9 Catalog No: AG000MLP MDL No:MFCD23701765
Product Description
Catalog Number:
AG000MLP
Chemical Name:
Acetic acid, amino[[(phenylmethoxy)carbonyl]amino]- (9CI)
CAS Number:
124676-23-9
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD23701765
IUPAC Name:
2-[amino(phenylmethoxycarbonyl)amino]acetic acid
InChI:
InChI=1S/C10H12N2O4/c11-12(6-9(13)14)10(15)16-7-8-4-2-1-3-5-8/h1-5H,6-7,11H2,(H,13,14)
InChI Key:
NZBYSZXBNXXLDB-UHFFFAOYSA-N
SMILES:
NC(C(=O)O)NC(=O)OCc1ccccc1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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