CAS 25611-78-3 | 1,2-Diphenylethanamine | CAS Number 25611-78-3

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25611-78-3 | 1,2-Diphenylethanamine

CAS No: 25611-78-3 Catalog No: AG003DEX MDL No:MFCD00008063

Product Description

Catalog Number:

AG003DEX

Chemical Name:

1,2-Diphenylethanamine

CAS Number:

25611-78-3

Molecular Formula:

C14H15N

Molecular Weight:

197.2756

MDL Number:

MFCD00008063

IUPAC Name:

1,2-diphenylethanamine

InChI:

InChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2

InChI Key:

DTGGNTMERRTPLR-UHFFFAOYSA-N

SMILES:

NC(c1ccccc1)Cc1ccccc1

EC Number:

247-126-4

Properties

Complexity:

166

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.12g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.281g/mol

Monoisotopic Mass:

197.12g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

26A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8

Literature

Title	Journal
Enantioselective synthesis of trans-dihydrobenzofurans via primary amine-thiourea organocatalyzed intramolecular Michael addition.	The Journal of organic chemistry 20120720
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
NMDA receptor affinities of 1,2-diphenylethylamine and 1-(1,2-diphenylethyl)piperidine enantiomers and of related compounds.	Bioorganic & medicinal chemistry 20090501