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13066-26-7 | 1,4-Benzenediamine, N1,N1-dimethyl-N4-sulfinyl-
CAS No: 13066-26-7 Catalog No: AG000URM MDL No:
Product Description
Catalog Number:
AG000URM
Chemical Name:
1,4-Benzenediamine, N1,N1-dimethyl-N4-sulfinyl-
CAS Number:
13066-26-7
Molecular Formula:
C8H10N2OS
Molecular Weight:
182.2428
IUPAC Name:
N,N-dimethyl-4-(sulfinylamino)aniline
InChI:
InChI=1S/C8H10N2OS/c1-10(2)8-5-3-7(4-6-8)9-12-11/h3-6H,1-2H3
InChI Key:
GBBKSKLYASMTIR-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1)N=S=O)C
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.051g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.241g/mol
Monoisotopic Mass:
182.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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