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1197239-04-5 | Benzenamine, 3,5-dichloro-N-methyl-, hydrochloride (1:1)
CAS No: 1197239-04-5 Catalog No: AG000PK8 MDL No:MFCD08456850
Product Description
Catalog Number:
AG000PK8
Chemical Name:
Benzenamine, 3,5-dichloro-N-methyl-, hydrochloride (1:1)
CAS Number:
1197239-04-5
Molecular Formula:
C7H8Cl3N
Molecular Weight:
212.5041
MDL Number:
MFCD08456850
IUPAC Name:
3,5-dichloro-N-methylaniline;hydrochloride
InChI:
InChI=1S/C7H7Cl2N.ClH/c1-10-7-3-5(8)2-6(9)4-7;/h2-4,10H,1H3;1H
InChI Key:
FKYROJJJGOMGDN-UHFFFAOYSA-N
SMILES:
CNc1cc(Cl)cc(c1)Cl.Cl
Properties
Complexity:
97.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.972g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
212.498g/mol
Monoisotopic Mass:
210.972g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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