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84971-65-3 | Carbamic acid, (3-chloro-4,5-diethoxyphenyl)-, ethyl ester
CAS No: 84971-65-3 Catalog No: AG004QK7 MDL No:
Product Description
Catalog Number:
AG004QK7
Chemical Name:
Carbamic acid, (3-chloro-4,5-diethoxyphenyl)-, ethyl ester
CAS Number:
84971-65-3
Molecular Formula:
C13H18ClNO4
Molecular Weight:
287.7393
IUPAC Name:
ethyl N-(3-chloro-4,5-diethoxyphenyl)carbamate
InChI:
InChI=1S/C13H18ClNO4/c1-4-17-11-8-9(15-13(16)19-6-3)7-10(14)12(11)18-5-2/h7-8H,4-6H2,1-3H3,(H,15,16)
InChI Key:
KMFXTLYHFDJATC-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1cc(Cl)c(c(c1)OCC)OCC
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.092g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.74g/mol
Monoisotopic Mass:
287.092g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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