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84970-52-5 | Carbamic acid, (3,5-dichloro-4-methoxyphenyl)-, 1-methylethyl ester
CAS No: 84970-52-5 Catalog No: AG004QKJ MDL No:
Product Description
Catalog Number:
AG004QKJ
Chemical Name:
Carbamic acid, (3,5-dichloro-4-methoxyphenyl)-, 1-methylethyl ester
CAS Number:
84970-52-5
Molecular Formula:
C11H13Cl2NO3
Molecular Weight:
278.1318
IUPAC Name:
propan-2-yl N-(3,5-dichloro-4-methoxyphenyl)carbamate
InChI:
InChI=1S/C11H13Cl2NO3/c1-6(2)17-11(15)14-7-4-8(12)10(16-3)9(13)5-7/h4-6H,1-3H3,(H,14,15)
InChI Key:
FNAZBFJGGIMYLO-UHFFFAOYSA-N
SMILES:
COc1c(Cl)cc(cc1Cl)NC(=O)OC(C)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.129g/mol
Monoisotopic Mass:
277.027g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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