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1003709-27-0 | Benzenamine, 2-chloro-N-(trifluoromethyl)-
CAS No: 1003709-27-0 Catalog No: AG0001S3 MDL No:MFCD09996988
Product Description
Catalog Number:
AG0001S3
Chemical Name:
Benzenamine, 2-chloro-N-(trifluoromethyl)-
CAS Number:
1003709-27-0
Molecular Formula:
C7H5ClF3N
Molecular Weight:
195.5695
MDL Number:
MFCD09996988
IUPAC Name:
2-chloro-N-(trifluoromethyl)aniline
InChI:
InChI=1S/C7H5ClF3N/c8-5-3-1-2-4-6(5)12-7(9,10)11/h1-4,12H
InChI Key:
RHZOXQJCQOHUID-UHFFFAOYSA-N
SMILES:
Clc1ccccc1NC(F)(F)F
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.006g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.569g/mol
Monoisotopic Mass:
195.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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