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1,3-Dihydroisobenzofuran

1,3-Dihydroisobenzofuran structure

CAS No:
496-14-0
Formula:
C8H8O
Chemical Name:
1,3-Dihydroisobenzofuran
Synonyms:
Isobenzofuran,1,3-dihydro-;Phthalan;1,3-Dihydroisobenzofuran;Isocoumaran;2-Oxaindan;Dihydroisobenzofuran;1,3-Dihydro-2-benzofuran
Categories:
Chemical Reagents > Organic Reagents

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Description

clear colourless to slightly yellow liquid

1,3-Dihydroisobenzofuran Basic Attributes

Molecular Weight：

120.15

Exact Mass：

120.15

BRN：

111932

EC Number：

207-815-2

UNII：

2R6NTQ7Y6G

DSSTox ID：

DTXSID60197920

HScode：

2932999099

Characteristics

PSA：

9.2

XLogP3：

1.85

Appearance：

Liquid

Density：

1.098 g/cm³ @ Temp: 0 °C

Melting Point：

6ºC

Boiling Point：

192 °C

Flash Point：

146 °F

Refractive Index：

1.560

Water Solubility：

Low aqueous solubility.

Storage Conditions：

Keep away from heat, sparks, and flame. Keep away from sources of ignition. Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Vapor Pressure：

0.696mmHg at 25°C

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

24/25-3/9/49

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Drug Information

MeSH Entry Terms：

1,3-dihydro isobenzofuran

Computed Properties

Molecular Weight:120.15
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Exact Mass:120.057514874
Monoisotopic Mass:120.057514874
Topological Polar Surface Area:9.2
Heavy Atom Count:9
Complexity:88.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes