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70660-48-9 | Carbamic acid,N-(3,4-dichlorophenyl)-, 2-[butyl(3-methylphenyl)amino]ethyl ester
CAS No: 70660-48-9 Catalog No: AG005GWX MDL No:
Product Description
Catalog Number:
AG005GWX
Chemical Name:
Carbamic acid,N-(3,4-dichlorophenyl)-, 2-[butyl(3-methylphenyl)amino]ethyl ester
CAS Number:
70660-48-9
Molecular Formula:
C20H24Cl2N2O2
Molecular Weight:
395.3228
IUPAC Name:
2-(N-butyl-3-methylanilino)ethyl N-(3,4-dichlorophenyl)carbamate
InChI:
InChI=1S/C20H24Cl2N2O2/c1-3-4-10-24(17-7-5-6-15(2)13-17)11-12-26-20(25)23-16-8-9-18(21)19(22)14-16/h5-9,13-14H,3-4,10-12H2,1-2H3,(H,23,25)
InChI Key:
IBUXMXQANREFOV-UHFFFAOYSA-N
SMILES:
CCCCN(c1cccc(c1)C)CCOC(=O)Nc1ccc(c(c1)Cl)Cl
EC Number:
274-728-4
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.121g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
395.324g/mol
Monoisotopic Mass:
394.121g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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