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13041-40-2 | Urea, N-(3,4-dichlorophenyl)-N'-heptyl-
CAS No: 13041-40-2 Catalog No: AG000UEM MDL No:
Product Description
Catalog Number:
AG000UEM
Chemical Name:
Urea, N-(3,4-dichlorophenyl)-N'-heptyl-
CAS Number:
13041-40-2
Molecular Formula:
C14H20Cl2N2O
Molecular Weight:
303.2274
IUPAC Name:
1-(3,4-dichlorophenyl)-3-heptylurea
InChI:
InChI=1S/C14H20Cl2N2O/c1-2-3-4-5-6-9-17-14(19)18-11-7-8-12(15)13(16)10-11/h7-8,10H,2-6,9H2,1H3,(H2,17,18,19)
InChI Key:
LOQMQPWRVINQQX-UHFFFAOYSA-N
SMILES:
CCCCCCCNC(=O)Nc1ccc(c(c1)Cl)Cl
NSC Number:
108145
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
303.227g/mol
Monoisotopic Mass:
302.095g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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