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3-Hexenedioic acid

3-Hexenedioic acid structure

3-Hexenedioic acid 

structure

Description

Solid

3-Hexenedioic acid Basic Attributes

144.12500

144.13

224-648-0

DTXSID3063461

2917190090

Characteristics

74.60000

0.49200

Solid

1.305g/cm3

197 °C

368.7ºC at 760 mmHg

191ºC

1.51

17 mg/mL

Safety Information

NONH for all modes of transport

3

S22-S24/25

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

3-Hexenedioic acid Use and Manufacturing

3-Hexenedioic acid: ACTIVE

Computed Properties

Molecular Weight:144.12
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:144.04225873
Monoisotopic Mass:144.04225873
Topological Polar Surface Area:74.6
Heavy Atom Count:10
Complexity:141
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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