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125418-72-6 | Ethanol, 2-[(4-methoxy-3-nitrophenyl)amino]-
CAS No: 125418-72-6 Catalog No: AG000NOM MDL No:
Product Description
Catalog Number:
AG000NOM
Chemical Name:
Ethanol, 2-[(4-methoxy-3-nitrophenyl)amino]-
CAS Number:
125418-72-6
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
IUPAC Name:
2-(4-methoxy-3-nitroanilino)ethanol
InChI:
InChI=1S/C9H12N2O4/c1-15-9-3-2-7(10-4-5-12)6-8(9)11(13)14/h2-3,6,10,12H,4-5H2,1H3
InChI Key:
BGANLZMZHWJPFY-UHFFFAOYSA-N
SMILES:
OCCNc1ccc(c(c1)[N+](=O)[O-])OC
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.205g/mol
Monoisotopic Mass:
212.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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