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83-68-1 | 1,4-Naphthalenediamine,2-methyl-
CAS No: 83-68-1 Catalog No: AG0056GI MDL No:
Product Description
Catalog Number:
AG0056GI
Chemical Name:
1,4-Naphthalenediamine,2-methyl-
CAS Number:
83-68-1
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
IUPAC Name:
2-methylnaphthalene-1,4-diamine
InChI:
InChI=1S/C11H12N2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6H,12-13H2,1H3
InChI Key:
BCKLPBBBFNWJHH-UHFFFAOYSA-N
SMILES:
Nc1cc(C)c(c2c1cccc2)N
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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