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Home > Nitro Compounds > 64393-30-2
64393-30-2 | 3-cyclopropyl-1-(4-nitrophenyl)urea
CAS No: 64393-30-2 Catalog No: AG019L33 MDL No:MFCD06107393
Product Description
Catalog Number:
AG019L33
Chemical Name:
3-cyclopropyl-1-(4-nitrophenyl)urea
CAS Number:
64393-30-2
Molecular Formula:
C10H11N3O3
Molecular Weight:
221.2126
MDL Number:
MFCD06107393
IUPAC Name:
1-cyclopropyl-3-(4-nitrophenyl)urea
InChI:
InChI=1S/C10H11N3O3/c14-10(11-7-1-2-7)12-8-3-5-9(6-4-8)13(15)16/h3-7H,1-2H2,(H2,11,12,14)
InChI Key:
MQIMUJATHBQCBY-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)[N+](=O)[O-])NC1CC1
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.216g/mol
Monoisotopic Mass:
221.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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