4,4,4-Trifluoro-1-phenyl-1,3-butanedione

Name: 4,4,4-Trifluoro-1-phenyl-1,3-butanedione
Brand: Jinan Shenghe Chemical Co., Ltd.
SKU: 36935
Availability: InStock

CAS 326-06-7C10H7F3O2MW 216.16

4,4,4-Trifluoro-1-phenyl-1,3-butanedione (CAS 326-06-7) — formula C10H7F3O2, molecular weight 216.16; category organic chemicals.

Specifications

CAS Number326-06-7

Molecular FormulaC10H7F3O2

Molecular Weight216.16

LogP2.6

CategoryOrganic Chemicals

Purchase Profile

What this product is

4,4,4-Trifluoro-1-phenyl-1,3-butanedione is a carbon-based organic compound with CAS registry number 326-06-7 and molecular formula C10H7F3O2 (molecular weight 216.16), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 326-06-7

Its molecular formula C10H7F3O2 comprises 10 C, 7 H, 3 F, 2 O atoms.

Also known as: 4,4,4-Trifluoro-1-phenyl-1,3-butanedione · Benzoyltrifluoroacetone

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 4,4,4-Trifluoro-1-phenyl-1,3-butanedione?

The CAS registry number of 4,4,4-Trifluoro-1-phenyl-1,3-butanedione is 326-06-7.

What is the molecular formula and molecular weight of 4,4,4-Trifluoro-1-phenyl-1,3-butanedione?

Molecular formula C10H7F3O2, molecular weight 216.16.

What other names is 4,4,4-Trifluoro-1-phenyl-1,3-butanedione known by?

It is also registered under: 4,4,4-Trifluoro-1-phenyl-1,3-butanedione, Benzoyltrifluoroacetone.

Which category does 4,4,4-Trifluoro-1-phenyl-1,3-butanedione belong to?

Category: Organic Chemicals.

PubChem Public Data

Public-database records for 4,4,4-Trifluoro-1-phenyl-1,3-butanedione (CAS 326-06-7), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary	20% (1 / 5)
Reported hazard statements	H302 (40%), H312 (40%), H315 (80%), H319 (80%), H332 (40%), H335 (80%)

This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.

H302 (40%): Harmful if swallowed [Warning Acute toxicity, oral]

Regulatory listings

GHS notification summary	20% (1 / 5)

Physical description and handling notes

Off-white crystalline solid; mp = 38-40 deg C; [Alfa Aesar MSDS]

How this substance is indexed

CAS Registry Number	326-06-7
PubChem CID	67589
分子式	C10H7F3O2
IUPAC 名称	4,4,4-trifluoro-1-phenylbutane-1,3-dione
UNII（FDA）	V9YSB8JR2P

Documented uses

Can trap reactive metabolites of carcinogens. [ChemIDplus]
1,3-Butanedione, 4,4,4-trifluoro-1-phenyl-: ACTIVE

Names this substance appears under

326-06-7; 4,4,4-Trifluoro-1-phenyl-1,3-butanedione; Benzoyl(trifluoroacetyl)methane; 1,3-Butanedione, 4,4,4-trifluoro-1-phenyl-; DTXSID2049268; NSC-42628; V9YSB8JR2P; DTXCID1029124; RefChem:506930; 4,4,4-TFBP; 206-307-8; 4,4,4-Trifluoro-1-phenylbutane-1,3-dione; Benzoyl-1,1,1-trifluoroacetone; Benzoyltrifluoroacetone; 3-Benzoyl-1,1,1-trifluoroacetone; MFCD00000425

Computed molecular descriptors

分子量	216.16
XLogP3	2.6
氢键供体数	0
氢键受体数	5
可旋转键数	3
精确质量	216.03981395
单同位素质量	216.03981395
拓扑极性表面积	34.1
重原子数	15
形式电荷	0

Database abstract

4,4,4-Trifluoro-1-phenyl-1,3-butanedione · CAS 326-06-7 · C10H7F3O2. UNII V9YSB8JR2P.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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