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Home Aminos 3,3'-Diaminodiphenylmethane

3,3'-Diaminodiphenylmethane

CAS No.:
19471-12-6
Catalog Number:
AG003ICN
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)(T)
1 week
United States
$138
- +
5g
>98.0%(GC)(T)
1 week
United States
$362
- +
Product Description
Catalog Number:
AG003ICN
Chemical Name:
3,3'-Diaminodiphenylmethane
CAS Number:
19471-12-6
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
MDL Number:
MFCD00014777
IUPAC Name:
3-[(3-aminophenyl)methyl]aniline
InChI:
InChI=1S/C13H14N2/c14-12-5-1-3-10(8-12)7-11-4-2-6-13(15)9-11/h1-6,8-9H,7,14-15H2
InChI Key:
CKOFBUUFHALZGK-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)Cc1cccc(c1)N
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Elimination kinetics of diisocyanates after specific inhalative challenges in humans: mass spectrometry analysis, as a basis for biomonitoring strategies. Journal of occupational medicine and toxicology (London, England) 20110101
Identification and characterization of novel sirtuin inhibitor scaffolds. Bioorganic & medicinal chemistry 20091001
Analysis of markers of exposure to polymeric methylene-diphenyl diisocyanate (pMDI) in rats: a comparison of dermal and inhalation routes of exposure. Experimental and toxicologic pathology : official journal of the Gesellschaft fur Toxikologische Pathologie 20020801
Properties