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2,2-Dichloro-1,4-butanediol

2,2-Dichloro-1,4-butanediol structure

CAS No:
3127-13-7
Formula:
C4H8Cl2O2
Chemical Name:
2,2-Dichloro-1,4-butanediol
Synonyms:
1,4-Butanediol,2,2-dichloro-;2,2-Dichloro-1,4-butanediol

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Description

beige crystalline low melting solid

2,2-Dichloro-1,4-butanediol Basic Attributes

Molecular Weight：

159.01100

Exact Mass：

159.01

DSSTox ID：

DTXSID60369246

HScode：

2905590090

Characteristics

PSA：

40.46000

XLogP3：

0.53500

Density：

1.414g/cm3

Melting Point：

80-81 °C

Boiling Point：

145-160 °C @ Press: 15 Torr

Flash Point：

133.9ºC

Refractive Index：

1.504

Computed Properties

Molecular Weight:159.01
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:157.9901349
Monoisotopic Mass:157.9901349
Topological Polar Surface Area:40.5
Heavy Atom Count:8
Complexity:65.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2-Dichloro-1,4-butanediol

Description
Basic Attributes
Characteristics
Computed Properties

2,2-Dichloro-1,4-butanediol

SDS

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