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84970-59-2 | Carbamic acid, (3,5-dichloro-4-methoxyphenyl)-, 2-butenyl ester
CAS No: 84970-59-2 Catalog No: AG004QKH MDL No:
Product Description
Catalog Number:
AG004QKH
Chemical Name:
Carbamic acid, (3,5-dichloro-4-methoxyphenyl)-, 2-butenyl ester
CAS Number:
84970-59-2
Molecular Formula:
C12H13Cl2NO3
Molecular Weight:
290.1425
IUPAC Name:
but-2-enyl N-(3,5-dichloro-4-methoxyphenyl)carbamate
InChI:
InChI=1S/C12H13Cl2NO3/c1-3-4-5-18-12(16)15-8-6-9(13)11(17-2)10(14)7-8/h3-4,6-7H,5H2,1-2H3,(H,15,16)
InChI Key:
CLHCMECMFFUVFS-UHFFFAOYSA-N
SMILES:
CC=CCOC(=O)Nc1cc(Cl)c(c(c1)Cl)OC
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.027g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.14g/mol
Monoisotopic Mass:
289.027g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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