| Identification | More | [Name]
Cinnamyl chloride | [CAS]
2687-12-9 | [Synonyms]
3-CHLORO-1-PHENYL-1-PROPENE
3-CHLORO-1-PHENYLPROPENE
(3-CHLORO-1-PROPENYL)BENZENE
(3-CHLOROPROPENYL)BENZENE
3-PHENYL-2-PROPENYL CHLORIDE
3-PHENYLALLYL CHLORIDE
AKOS 371
AKOS BBS-00003853
CINNAMYL CHLORIDE
(3-chloro-1-propenyl)-benzen
(3-chloro-prop-1-enyl)-benzene
(3-chloropropenyl)-benzen
[(1E)-3-Chloro-1-propenyl]benzene
1-Phenyl-3-chloro-1-propene
1-Propene, 3-chloro-1-phenyl-
Benzene, (3-chloropropenyl)-
Benzene,(3-chloro-1-propenyl)-
beta-chloromethylstyrene
Propene, 3-chloro-1-phenyl-
r-Chloropropenylbenzene | [EINECS(EC#)]
220-246-4 | [Molecular Formula]
C9H9Cl | [MDL Number]
MFCD00000986 | [Molecular Weight]
152.62 | [MOL File]
2687-12-9.mol |
| Chemical Properties | Back Directory | [Appearance]
yellow to yellow-brown liquid | [Melting point ]
-19 °C (lit.) | [Boiling point ]
108 °C/12 mmHg (lit.) | [density ]
1.096 g/mL at 25 °C(lit.)
| [vapor pressure ]
2Pa at 20℃ | [refractive index ]
n20/D 1.584(lit.)
| [Fp ]
175 °F
| [storage temp. ]
Refrigerator (+4°C) | [form ]
Liquid | [color ]
Yellow to yellow-brown | [Water Solubility ]
0.2 g/L (20 ºC) | [Sensitive ]
Lachrymatory | [BRN ]
741974 | [InChI]
1S/C9H9Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2/b7-4+ | [InChIKey]
IWTYTFSSTWXZFU-QPJJXVBHSA-N | [SMILES]
ClC\C=C\c1ccccc1 | [LogP]
3.3 | [CAS DataBase Reference]
2687-12-9(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzene, (3-chloro-1-propenyl)-(2687-12-9) | [EPA Substance Registry System]
2687-12-9(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
T+,C | [Risk Statements ]
R22:Harmful if swallowed.
R26:Very Toxic by inhalation.
R34:Causes burns.
R43:May cause sensitization by skin contact.
R36:Irritating to the eyes. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S27:Take off immediately all contaminated clothing . | [RIDADR ]
UN 1760 8/PG 2
| [WGK Germany ]
3
| [RTECS ]
CZ0919905
| [Hazard Note ]
Corrosive/Lachrymatory | [TSCA ]
Yes | [HazardClass ]
8 | [PackingGroup ]
III | [HS Code ]
29039990 | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Muta. 2
Repr. 2
Skin Irrit. 2
Skin Sens. 1B
STOT RE 2 | [Toxicity]
rat,LC50,inhalation,29mg/m3/4H (29mg/m3),BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION,Toksikologicheskii Vestnik. Vol. (4), Pg. 30, 1997. |
| Hazard Information | Back Directory | [Chemical Properties]
yellow to yellow-brown liquid | [Uses]
Cinnamyl chloride is used in the enantioselective total synthesis of helioporins C and E, bioactive marine diterpenes. | [General Description]
Cinnamyl chloride reacts regioselectively with aryl and alkenylgold(I) phosphanes in the presence of palladium catalyst in THF to afford the α-substitution product?. |
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