1,1-Diphenylethanol

CAT: 0127-OR930645-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR930645-01Size:5 g

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CAS Number

599-67-7

MDL Number

MFCD00004450

Purity

98%

Smiles

CC(O)(c1ccccc1)c2ccccc2

Chemical Information

1,1-Diphenylethanol

CAS Number	599-67-7
PubChem CID	69031
IUPAC Name	1,1-diphenylethanol
Molecular Formula	C14H14O
Molecular Weight	198.26
XLogP	2.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	170

SMILES

CC(C1=CC=CC=C1)(C2=CC=CC=C2)O

InChI

InChI=1S/C14H14O/c1-14(15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15H,1H3

InChIKey

GIMDPFBLSKQRNP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 599-67-7

CID: 69031

Formula: C14H14O

MW: 198.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	198.26
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	198.104465066
Monoisotopic Mass	198.104465066
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	170
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FD00046-01	1,1-Diphenylethanol
GTR19254378-01	1,2-Diphenylethanol
228982-01	1,1-Diphenylethanol ≥97% (GC)
sc-227982	Erythro-2-Anilino-1,2-diphenylethanol
260230-01	(1R,2S) - (-) -2-Amino-1,2-diphenylethanol
HY-76274-01	(1S,2R) -2-Amino-1,2-diphenylethanol
412679-01	(1S,2R) - (+) -2-Amino-1,2-diphenylethanol
HY-W007825-01	(1R,2S) -2-Amino-1,2-diphenylethanol
AR-C03200-01	1- (4- (2- (diethylamino) ethoxy) phenyl) -1,2-diphenylethanol
TRC-A607880-25G	(1R,2S)-(-)-2-Amino-1,2-diphenylethanol