Caprolactone - Materials / Alfa Chemistry

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Caprolactone

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Catalog Number

ACMA00016873

Product Name

Caprolactone

Category

Polymers

Description

Liquid;COLOURLESS HYGROSCOPIC LIQUID WITH CHARACTERISTIC ODOUR.

IUPAC Name

oxepan-2-one

Molecular Weight

114.14g/mol

Molecular Formula

C6H10O2;C6H10O2

Canonical SMILES

C1CCC(=O)OCC1

InChI

InChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H2

InChI Key

PAPBSGBWRJIAAV-UHFFFAOYSA-N

Boiling Point

215.0 °C;237 °C

Melting Point

-18.0 °C;-1.5 °C

Flash Point

127 °C o.c.

Density

1.07 g/cm³;Relative density of the vapour/air-mixture at 20 °C (air = 1): 1.00

Solubility

Solubility in water: miscible

Complexity

88.5

Covalently-Bonded Unit Count

EC Number

207-938-1

Exact Mass

114.06808g/mol

Formal Charge

Heavy Atom Count

ICSC Number

1741

Log P

log Kow= 1.215 (calc);0.68

MeSH Entry Terms

caprolactone;epsilon-caprolactone;epsilon-captolactamium hydrogen sulfate

Monoisotopic Mass

114.06808g/mol

Other Experimental

Henry's Law constant= 1.809X10-4 atm-cu m/mole at 25 °C (est)

Rotatable Bond Count

UNII

56RE988L1R

Vapor Density

Relative vapor density (air = 1): 3.9

Vapor Pressure

0.13 mmHg;1.35X10-1 mm Hg at 25 °C;Vapor pressure, Pa at 25 °C: 0.8

XLogP3

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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