200,000+ products from a single source!
sales@angenechem.com
85221-18-7 | Carbamic acid,(3,4-dichlorophenyl)-, 2,2,2-trichloroethyl ester (9CI)
CAS No: 85221-18-7 Catalog No: AG004M5J MDL No:
Product Description
Catalog Number:
AG004M5J
Chemical Name:
Carbamic acid,(3,4-dichlorophenyl)-, 2,2,2-trichloroethyl ester (9CI)
CAS Number:
85221-18-7
Molecular Formula:
C9H5Cl5NO2-
Molecular Weight:
336.4065
IUPAC Name:
2,2,2-trichloroethyl N-(3,4-dichlorophenyl)carbamate
InChI:
InChI=1S/C9H6Cl5NO2/c10-6-2-1-5(3-7(6)11)15-8(16)17-4-9(12,13)14/h1-3H,4H2,(H,15,16)
InChI Key:
OOHJLYSGGJCZCO-UHFFFAOYSA-N
SMILES:
[O-]C(=O)N(c1ccc(c(c1)Cl)Cl)CC(Cl)(Cl)Cl
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.881g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
337.402g/mol
Monoisotopic Mass:
334.884g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.