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3171-46-8 | 3,5-Dimethylbenzene-1,2-diamine
CAS No: 3171-46-8 Catalog No: AG003IO9 MDL No:MFCD00972722
Product Description
Catalog Number:
AG003IO9
Chemical Name:
3,5-Dimethylbenzene-1,2-diamine
CAS Number:
3171-46-8
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
MDL Number:
MFCD00972722
IUPAC Name:
3,5-dimethylbenzene-1,2-diamine
InChI:
InChI=1S/C8H12N2/c1-5-3-6(2)8(10)7(9)4-5/h3-4H,9-10H2,1-2H3
InChI Key:
DMEPVFSJYHJGCD-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)N)N
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
136.198g/mol
Monoisotopic Mass:
136.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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