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78235-07-1 | Benzenamine, 2-chloro-N-(1-methylethyl)-
CAS No: 78235-07-1 Catalog No: AG0054B5 MDL No:MFCD11145140
Product Description
Catalog Number:
AG0054B5
Chemical Name:
Benzenamine, 2-chloro-N-(1-methylethyl)-
CAS Number:
78235-07-1
Molecular Formula:
C9H12ClN
Molecular Weight:
169.6513
MDL Number:
MFCD11145140
IUPAC Name:
2-chloro-N-propan-2-ylaniline
InChI:
InChI=1S/C9H12ClN/c1-7(2)11-9-6-4-3-5-8(9)10/h3-7,11H,1-2H3
InChI Key:
JCRMYLUIMGTZSR-UHFFFAOYSA-N
SMILES:
CC(Nc1ccccc1Cl)C
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.066g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.652g/mol
Monoisotopic Mass:
169.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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