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Home > Nitro Compounds > 36894-29-8
36894-29-8 | 1,1-Dimethyl-3-(2-nitrophenyl)urea
CAS No: 36894-29-8 Catalog No: AG00CVD3 MDL No:MFCD01034780
Product Description
Catalog Number:
AG00CVD3
Chemical Name:
1,1-Dimethyl-3-(2-nitrophenyl)urea
CAS Number:
36894-29-8
Molecular Formula:
C9H11N3O3
Molecular Weight:
209.2019
MDL Number:
MFCD01034780
IUPAC Name:
1,1-dimethyl-3-(2-nitrophenyl)urea
InChI:
InChI=1S/C9H11N3O3/c1-11(2)9(13)10-7-5-3-4-6-8(7)12(14)15/h3-6H,1-2H3,(H,10,13)
InChI Key:
FRBHCWIPAUJHEP-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Nc1ccccc1[N+](=O)[O-]
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.205g/mol
Monoisotopic Mass:
209.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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