Identification | More | [Name]
4-Chlorobutyl acetate | [CAS]
6962-92-1 | [Synonyms]
1-ACETOXY-4-CHLOROBUTANE 4-ACETOXY-1-CHLOROBUTANE 4-CHLORO-1-BUTANOL ACETATE 4-CHLOROBUTYL ACETATE ACETIC ACID 4-CHLOROBUTYL ESTER 1-Chloro-4-acetoxybutane 4-Chlorbut-1-ylacetat 4-chloro-1-butanoacetate 4-Chloro-n-butyl acetate delta-Chlorobutyl acetate delta-chlorobutylacetate omega-Chlorobutyl acetate 1-Butanol, 4-chloro-, acetate 4-Chlorobutyl acetate,98% 1-ACETOXY-4-CHLOROBUTANE/4-CHLOROBUTYL ACETATE 4-Acetoxybutyl chloride | [EINECS(EC#)]
230-158-8 | [Molecular Formula]
C6H11ClO2 | [MDL Number]
MFCD00001013 | [Molecular Weight]
150.6 | [MOL File]
6962-92-1.mol |
Chemical Properties | Back Directory | [Appearance]
clear colorless liquid | [Boiling point ]
92 °C/22 mmHg (lit.) | [density ]
1.072 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.434(lit.)
| [Fp ]
148 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform (Slightly), Ethyl Acetate (Slightly) | [form ]
Oil | [color ]
Clear Colourless | [Specific Gravity]
1.08 | [Water Solubility ]
inmisceable | [BRN ]
1749681 | [InChI]
InChI=1S/C6H11ClO2/c1-6(8)9-5-3-2-4-7/h2-5H2,1H3 | [InChIKey]
PYLDCZJUHYVOAF-UHFFFAOYSA-N | [SMILES]
C(OC(=O)C)CCCCl | [CAS DataBase Reference]
6962-92-1(CAS DataBase Reference) | [NIST Chemistry Reference]
1-Butanol, 4-chloro-, acetate(6962-92-1) | [EPA Substance Registry System]
6962-92-1(EPA Substance) |
Safety Data | Back Directory | [Hazard Codes ]
Xi,Xn | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . R22:Harmful if swallowed. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36:Wear suitable protective clothing . S37/39:Wear suitable gloves and eye/face protection . | [RIDADR ]
3272 | [WGK Germany ]
3
| [RTECS ]
EL1328000
| [TSCA ]
Yes | [PackingGroup ]
III | [HS Code ]
2915907098 |
Hazard Information | Back Directory | [Chemical Properties]
clear colorless liquid | [Uses]
4-Chlorobutyl Acetate is a reagent used in the synthesis of novel cyclic ADP ribose derivatives. Also used in the synthesis of a transient receptor potential melastatin 2 antagonist involved in insulin secretion. | [Synthesis Reference(s)]
Chemistry Letters, 16, p. 953, 1987 The Journal of Organic Chemistry, 48, p. 751, 1983 DOI: 10.1021/jo00153a031 |
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