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Home > Encyclopedia > 1,4-Cyclohexanedicarboxylic acid

1,4-Cyclohexanedicarboxylic acid

1,4-Cyclohexanedicarboxylic acid structure

1,4-Cyclohexanedicarboxylic acid 

structure
  • CAS No:

    1076-97-7

  • Formula:

    C8H12O4

  • Chemical Name:

    1,4-Cyclohexanedicarboxylic acid

  • Synonyms:

    1,4-Cyclohexanedicarboxylic acid;1,4-Benzenedicarboxylic acid,hexahydro-;Hexahydroterephthalic acid;1,4-Dicarboxycyclohexane;1,4-CHDA-HP;Rikacid CHDA

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

DryPowder


DryPowder


1,4-cyclohexanedicarboxylic acid is a dicarboxylic acid that is cyclohexane substituted by carboxy groups at positions 1 and 4.

1,4-Cyclohexanedicarboxylic acid Basic Attributes

172.18

172.18

214-068-6

68QED0R44U|18W55738KH

61121|621

DTXSID2038788

2917209090

Characteristics

74.6

0.5

DryPowder

1.3±0.1 g/cm3

67 °C

384.1ºC at 760 mmHg

200.3±22.4 °C

1.521

SOLUBLE

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

0.0112mmHg at 25°C

Safety Information

NONH for all modes of transport

3

R22;R36

S26-S36

GU9060000

Xn:Harmful

Stable under normal temperatures and pressures.

P305 + P351 + P338

H302-H319

|Warning|H302 (28.95%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 368 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 15 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

1,4-Cyclohexanedicarboxylic acid Use and Manufacturing

Uses

Intermediates


Paints and coatings

All other basic organic chemical manufacturing|1,4-Cyclohexanedicarboxylic acid: ACTIVE

Computed Properties

Molecular Weight:172.18
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:172.07355886
Monoisotopic Mass:172.07355886
Topological Polar Surface Area:74.6
Heavy Atom Count:12
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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