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2357-78-0 | Carbanilic acid, 2,4-difluoro-, isopropyl ester (7CI,8CI)
CAS No: 2357-78-0 Catalog No: AG002NPU MDL No:
Product Description
Catalog Number:
AG002NPU
Chemical Name:
Carbanilic acid, 2,4-difluoro-, isopropyl ester (7CI,8CI)
CAS Number:
2357-78-0
Molecular Formula:
C10H11F2NO2
Molecular Weight:
215.1966
IUPAC Name:
propan-2-yl N-(2,4-difluorophenyl)carbamate
InChI:
InChI=1S/C10H11F2NO2/c1-6(2)15-10(14)13-9-4-3-7(11)5-8(9)12/h3-6H,1-2H3,(H,13,14)
InChI Key:
IRPAVMSCKAYBHQ-UHFFFAOYSA-N
SMILES:
CC(OC(=O)Nc1ccc(cc1F)F)C
NSC Number:
51610
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.076g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.2g/mol
Monoisotopic Mass:
215.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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