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84970-69-4 | Carbamic acid, (3,5-dichloro-4-propoxyphenyl)-, 1-methylethyl ester
CAS No: 84970-69-4 Catalog No: AG004UJX MDL No:
Product Description
Catalog Number:
AG004UJX
Chemical Name:
Carbamic acid, (3,5-dichloro-4-propoxyphenyl)-, 1-methylethyl ester
CAS Number:
84970-69-4
Molecular Formula:
C13H17Cl2NO3
Molecular Weight:
306.1850
IUPAC Name:
propan-2-yl N-(3,5-dichloro-4-propoxyphenyl)carbamate
InChI:
InChI=1S/C13H17Cl2NO3/c1-4-5-18-12-10(14)6-9(7-11(12)15)16-13(17)19-8(2)3/h6-8H,4-5H2,1-3H3,(H,16,17)
InChI Key:
MQZNPTADZQUIJX-UHFFFAOYSA-N
SMILES:
CCCOc1c(Cl)cc(cc1Cl)NC(=O)OC(C)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.059g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.183g/mol
Monoisotopic Mass:
305.059g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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