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141209-18-9 | Glycine, N-(carboxymethyl)-N-[4-[(4-nitrophenyl)azo]phenyl]- (9CI)
CAS No: 141209-18-9 Catalog No: AG001G1Z MDL No:
Product Description
Catalog Number:
AG001G1Z
Chemical Name:
Glycine, N-(carboxymethyl)-N-[4-[(4-nitrophenyl)azo]phenyl]- (9CI)
CAS Number:
141209-18-9
Molecular Formula:
C16H14N4O6
Molecular Weight:
358.3056
IUPAC Name:
2-[N-(carboxymethyl)-4-[(4-nitrophenyl)diazenyl]anilino]acetic acid
InChI:
InChI=1S/C16H14N4O6/c21-15(22)9-19(10-16(23)24)13-5-1-11(2-6-13)17-18-12-3-7-14(8-4-12)20(25)26/h1-8H,9-10H2,(H,21,22)(H,23,24)
InChI Key:
MYGHMDOOHQOWMS-UHFFFAOYSA-N
SMILES:
OC(=O)CN(c1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-])CC(=O)O
Properties
Complexity:
517
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.091g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
358.31g/mol
Monoisotopic Mass:
358.091g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
148A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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