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1193389-58-0 | Benzenamine, 2,5-dichloro-N-methyl-, hydrochloride (1:1)
CAS No: 1193389-58-0 Catalog No: AG000IMK MDL No:MFCD12197277
Product Description
Catalog Number:
AG000IMK
Chemical Name:
Benzenamine, 2,5-dichloro-N-methyl-, hydrochloride (1:1)
CAS Number:
1193389-58-0
Molecular Formula:
C7H8Cl3N
Molecular Weight:
212.5041
MDL Number:
MFCD12197277
IUPAC Name:
2,5-dichloro-N-methylaniline;hydrochloride
InChI:
InChI=1S/C7H7Cl2N.ClH/c1-10-7-4-5(8)2-3-6(7)9;/h2-4,10H,1H3;1H
InChI Key:
VJYJHQCCZQKENF-UHFFFAOYSA-N
SMILES:
CNc1cc(Cl)ccc1Cl.Cl
Properties
Complexity:
108
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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