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13208-64-5 | Urea, N-(4-chlorophenyl)-N'-propyl-
CAS No: 13208-64-5 Catalog No: AG00106C MDL No:MFCD00018553
Product Description
Catalog Number:
AG00106C
Chemical Name:
Urea, N-(4-chlorophenyl)-N'-propyl-
CAS Number:
13208-64-5
Molecular Formula:
C10H13ClN2O
Molecular Weight:
212.6760
MDL Number:
MFCD00018553
IUPAC Name:
1-(4-chlorophenyl)-3-propylurea
InChI:
InChI=1S/C10H13ClN2O/c1-2-7-12-10(14)13-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,13,14)
InChI Key:
ZOHMWYYUJMHIGF-UHFFFAOYSA-N
SMILES:
CCCNC(=O)Nc1ccc(cc1)Cl
NSC Number:
109558
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.677g/mol
Monoisotopic Mass:
212.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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