Benzylcinnamat

2-Propenoic acid, 3-phenyl-, phenylmethyl ester

HCID 7652
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Grundinformationen

CAS
103-41-3
Standard-SMILES
O=C(C=Cc1ccccc1)OCc1ccccc1
InChIKey
NGHOLYJTSCBCGC-UHFFFAOYSA-N
Summenformel
C16H14O2
Durchschnittliche Molmasse
238,28 g/mol
Monoisotopische Masse
238,09937969

Namen und Bezeichner

Bevorzugter Name
2-Propenoic acid, 3-phenyl-, phenylmethyl ester
IUPAC
benzyl 3-phenylprop-2-enoate
Lokaler Name
Benzylcinnamat
Englischer Name
Benzyl cinnamate
Summenformel
C16H14O2
Molmasse
238.28

Namen und Synonyme

benzyl 3-phenylprop-2-enoate2-Propenoic acid, 3-phenyl-, phenylmethyl esterRefChem:482083Benzylbeta-phenylacrylateMFCD00004789Cinnamic acid-benzyl esterbenzyl-3-phenyl-propenoateSCHEMBL43213orb1299180orb3139343CHEMBL2361576SCHEMBL10352885
Weitere Namen anzeigen
CINNAMEINFEMA 2142guisuanbianzhiBenzyl ciamateBenzyl cinmateBENZYL CINNAMATEBenzylcinnamoateBENZYL CINNAMATE(P)Benzyl cinnamate-RM
3-Phenyl-acrylic acid benzyl esters5167AKOS025243955SY015224DS-002671NS00075622Cinnamic acid-benzyl ester 1000 microg/mL in Acetonitrile8014-16-2

Datenbank-Bezeichner

CAS
103-41-3
PubChem CID
7652
DTXSID
DTXSID3041663
ChEMBL
CHEMBL2361576

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,8
Polarare Oberfläche (TPSA)
26,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
5
Schwere Atome
18

Physikochemische Eigenschaften

Schmelzpunkt
34 · 34-37 °C (lit.)
Siedepunkt
195 · 195-200 °C/5 mmHg (lit.)
Dichte
1.11 · 1.11
Dampfdruck
0.1 hPa · <0.1 hPa (20 °C)
FEMA
2142 · 2142 | BENZYL CINNAMATE
Brechungsindex
1.4025 · 1.4025-1.4045

Sicherheit und Regulatorisches

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: 2-Propenoic acid, 3-phenyl-, phenylmethyl ester

Hazard Traits - Fragrance Allergen；Authoritative List - Annex III of the EU Cosmetics Regulation No. 1223/2009 - Fragrance Allergens；Report - if present in a rinse-off cosmetic product at a concentration at or above 0.01 percent (100 parts per million) or in a leave-on cosmetic product at a concentration at or above 0.001 percent (10 parts per million)

Benzyl cinnamate: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Chemicals with limited data availability that are used in fragrances: Human health tier II assessment

Toxikologische Informationen

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

Regulatorische Informationen

Regulatory Information · 3 Einträge

Chemical: 2-Propenoic acid, 3-phenyl-, phenylmethyl ester

Hazard Traits - Fragrance Allergen；Authoritative List - Annex III of the EU Cosmetics Regulation No. 1223/2009 - Fragrance Allergens；Report - if present in a rinse-off cosmetic product at a concentration at or above 0.01 percent (100 parts per million) or in a leave-on cosmetic product at a concentration at or above 0.001 percent (10 parts per million)

Benzyl cinnamate: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

wgk
2
tsca
TSCA listed
ridadr
3077
hs_code
29163900
RTECS-Nr.
GD8400000
risk_code
36/37/38

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing Information2-Propenoic acid, 3-phenyl-, phenylmethyl ester: ACTIVE

Anwendungen

OccurrenceReported found in Peru and Tolu balsam, in Sumatra and Penang benzoin, and as the main constituent of copaiba balsam.

VerwendenBenzyl cinnamate has been employed as internal standard during the determination of compounds commonly added to personal care products such as UV filters and antimicrobial agents in environmental samples.

Darstellung

synthetischeBy heating benzyl chloride and excess sodium cinnamate in water to 100 to 115°C; by heating sodium cinnamate with an excess of benzyl chloride in the presence of diethylamine.

Vor- und nachgelagerte Produkte

Anbieter100 Anbieter

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

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