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2,2-Diphenylethylamine

CAT: 0013-GTR19254308-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19254308-01Size:100 mg
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Description
2,2-Diphenylethylamine , with CAS No. 3963-62-0, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2,2-Diphenylethylamine provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
3963-62-0
Product Name Alternative
Compound 3963 62 0, Compound 3963620
Purity
96.53% (May vary between batches)
Smiles
NCC (c1ccccc1) c1ccccc1
Molecular Formula
C14H15N
Molecular Weight
197.281
Storage Conditions
Pure form: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

2,2-Diphenylethylamine
CAS Number3963-62-0
PubChem CID77575
IUPAC Name2,2-diphenylethanamine
Molecular FormulaC14H15N
Molecular Weight197.27
XLogP2.1
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity148
SMILES
C1=CC=C(C=C1)C(CN)C2=CC=CC=C2
InChI
InChI=1S/C14H15N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11,15H2
InChIKey
RXMTUVIKZRXSSM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,2-Diphenylethylamine
CAS: 3963-62-0
CID: 77575
Formula: C14H15N
MW: 197.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight197.27
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass197.120449483
Monoisotopic Mass197.120449483
Topological Polar Surface Area26 Ų
Heavy Atom Count15
Formal Charge0
Complexity148
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
274088-012,2-Diphenylethylamine
OR932559-011,2-Diphenylethylamine
230770-012,2-Diphenylethylamine 98+% (GC)
OR304019(R) - (+) -1-Benzyl-2,2-diphenylethylamine
sc-236711(S) - (-) -1-Benzyl-2,2-diphenylethylamine
PC301006(R) -1-Benzyl-2-fluoro-2,2-diphenylethylamine
sc-287418(1S,2S) -2- (Diphenylphosphino) -1,2-diphenylethylamine
PC301007(S) -1-Benzyl-2-fluoro-2,2-diphenylethylamine
TRC-M253955-500MG3-Mercapto-2-methylpropanoic Acid 1,2-Diphenylethylamine Salt
ZAA30190-01(+) -N, N-Dimethyl-1,2-diphenylethylamine hydrochloride

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