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1,1-Diphenylethanol - >98.0%, high purity , CAS No.599-67-7

COA

Grade & Purity:

≥98%

Cas Number: 599-67-7
Molecular Weight: 198.27
Beilstein Registry Number: 6685
MDL number: MFCD00004450
PubChem CID: 69031
PubChem SID: 504754324

In stock

Item Number

D154163

Grouped product items
SKU	Size	Availability	Price
D154163-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
D154163-5g	5g	3	$36.90
D154163-25g	25g	3	$162.90
D154163-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$584.90

View related series

alcohol (850) Non heterocyclic block (8163)

Basic Description

Synonyms	Q27459202 \| UNII-8V681BNM35 \| 1-HYDROXY-1,1-DIPHENYLETHANE \| a-Methylbenzhydrol \| W-105292 \| Benzhydrol, alpha-methyl- \| alpha-Methylbenzhydrol \| NSC33 \| NSC-33 \| 1,1-diphenylethan-1-ol \| .alpha.-Methylbenzhydrol \| A832556 \| Benzhydrol, .alpha.-methyl- \|
Specifications & Purity	≥98%
Shipped In	Normal
Product Description	The H-bonds in 1,1-diphenylethanol were studied by means of infrared (IR) absorption spectra.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Diphenylmethanes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Tertiary alcohols Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylmethane - Tertiary alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504754324
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754324
IUPAC Name	1,1-diphenylethanol
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
Smiles	CC(C1=CC=CC=C1)(C2=CC=CC=C2)O
Isomeric SMILES	CC(C1=CC=CC=C1)(C2=CC=CC=C2)O
WGK Germany	3
Molecular Weight	198.27
Beilstein	6685
Reaxy-Rn	1867726
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1867726&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
D2510043	Certificate of Analysis	Apr 21, 2025	D154163
K1921072	Certificate of Analysis	Sep 07, 2023	D154163
F2326114	Certificate of Analysis	Jul 05, 2023	D154163

Chemical and Physical Properties

Boil Point(°C)	155°C/12mmHg
Melt Point(°C)	77-82℃
Molecular Weight	198.260 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	198.104 Da
Monoisotopic Mass	198.104 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	170.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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