Ethanone,2,2-dihydroxy-1-(4-phenoxyphenyl)-

CAS

92254-55-2

Catalog Number

ACM92254552

Category

Other Products

Molecular Weight

244.24

Molecular Formula

C₁₄H₁₂O₄

MSDS COA Spec Sheet

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Specification

Synonyms

4-PHENOXYPHENYLGLYOXAL HYDRATE;4-Phenoxyphenylglyoxal hydrate 95%;4-PHENOXYPHENYLGLYOXAL HYDRATE, 95+%;Zinc01569637

IUPAC Name

2-oxo-2-(4-phenoxyphenyl)acetaldehyde

Canonical SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C=O.O

InChI Key

RCMGUDDPKUIMTI-UHFFFAOYSA-N

Boiling Point

417.5ºC at 760mmHg

Flash Point

206.3ºC

Density

g/cm³

Exact Mass

244.07400

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The molecular formula is C14H12O4.

What are the synonyms for 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The synonyms are 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone, CS-0156089, Oxo-(4-phenoxy-phenyl)-acetaldehyde hydrate, and ETHANONE,2,2-DIHYDROXY-1-(4-PHENOXYPHENYL)-.

What is the molecular weight of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The molecular weight is 244.24 g/mol.

What is the IUPAC name of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The IUPAC name is 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone.

What is the InChI of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The InChI is InChI=1S/C14H12O4/c15-13(14(16)17)10-6-8-12(9-7-10)18-11-4-2-1-3-5-11/h1-9,14,16-17H.

What is the InChIKey of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The InChIKey is YXORSXKQALCDKI-UHFFFAOYSA-N.

What is the canonical SMILES of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The canonical SMILES is C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C(O)O.

What is the XLogP3-AA value of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The XLogP3-AA value is 1.9.

What is the hydrogen bond donor count of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The hydrogen bond donor count is 2.

What is the hydrogen bond acceptor count of 2,2-dihydroxy-1-(4-phenoxyphenyl)ethanone?

The hydrogen bond acceptor count is 4.