1,3-Diphenyl-2-propanone (CAS 102-04-5) — formula C15H14O, molecular weight 210.10 g/mol.
Documented applications: Uses: Used as a flavoring agent or adjuvant, [FDA], Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, General Manufacturing Information: 2-Propanone, 1, 3-diphenyl-: ACTIVE.
1,3-Diphenyl-2-propanone is a chemical compound with CAS registry number 102-04-5 and molecular formula C15H14O (molecular weight 210.10 g/mol).
CAS number: 102-04-5
Its molecular formula C15H14O comprises 15 C, 14 H, 1 O atoms.
Also known as: 1,3-Diphenyl-2-propanone · DIBENZYL KETONE · 1,3-Diphenylacetone
The CAS registry number of 1,3-Diphenyl-2-propanone is 102-04-5.
Molecular formula C15H14O, molecular weight 210.10 g/mol.
It is also registered under: 1,3-Diphenyl-2-propanone, DIBENZYL KETONE, 1,3-Diphenylacetone.
Recorded applications: Uses: Used as a flavoring agent or adjuvant, [FDA], Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, General Manufacturing Information: 2-Propanone, 1, 3-diphenyl-: ACTIVE.
Public-database records for 1,3-Diphenyl-2-propanone (CAS 102-04-5), reproduced here for independent cross-checking.
| GHS 通报统计 | 100% (90 / 90) |
|---|
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Cut Grass No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 100% (90 / 90) |
| 沸点 | 330.00 to 331.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 330 °C |
| 熔点 | 35 - 36 °C |
| CAS 号 | 102-04-5 |
|---|---|
| PubChem CID | 7593 |
| 分子式 | C15H14O |
| 分子量 | 210.10 g/mol |
| IUPAC 名称 | 1,3-diphenylpropan-2-one |
| InChIKey | YFKBXYGUSOXJGS-UHFFFAOYSA-N |
| UNII（FDA） | 9Y07G5UDKQ |
| ChEBI 编号 | CHEBI:174059 |
| FEMA 编号 | 2397 |
| JECFA 编号 | 832 |
1,3-Diphenylacetone; 102-04-5; 1,3-diphenylpropan-2-one; 1,3-Diphenyl-2-propanone; DIBENZYL KETONE; 2-Propanone, 1,3-diphenyl-; Benzyl ketone; 1,3-Diphenylpropanone; alpha,alpha'-Diphenylacetone; FEMA No. 2397; NSC 220312; AI3-05001; EINECS 203-000-0; 9Y07G5UDKQ; NSC-220312; DTXSID5059244
| 分子量 | 210.27 |
|---|---|
| XLogP3 | 3.1 |
| 氢键供体数 | 0 |
| 氢键受体数 | 1 |
| 可旋转键数 | 4 |
| 精确质量 | 210.104465066 |
| 单同位素质量 | 210.104465066 |
| 拓扑极性表面积 | 17.1 |
| 重原子数 | 16 |
| 形式电荷 | 0 |
二苄基甲酮 的 CAS 号为 102-04-5，分子式 C15H14O，分子量 210.10 g/mol。 UNII 9Y07G5UDKQ; ChEBI 174059; InChIKey YFKBXYGUSOXJGS-UHFFFAOYSA-N. 沸点: 330.00 to 331.00 °C. @ 760.00 mm Hg; 沸点: 330 °C; 熔点: 35 - 36 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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