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Home > Nitro Compounds > 337906-35-1
337906-35-1 | 2-(methoxymethyl)-4-nitroaniline
CAS No: 337906-35-1 Catalog No: AG019Z6D MDL No:MFCD16689741
Product Description
Catalog Number:
AG019Z6D
Chemical Name:
2-(methoxymethyl)-4-nitroaniline
CAS Number:
337906-35-1
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD16689741
IUPAC Name:
2-(methoxymethyl)-4-nitroaniline
InChI:
InChI=1S/C8H10N2O3/c1-13-5-6-4-7(10(11)12)2-3-8(6)9/h2-4H,5,9H2,1H3
InChI Key:
NEXYZYSYGLNANJ-UHFFFAOYSA-N
SMILES:
COCc1cc(ccc1N)[N+](=O)[O-]
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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