4-Methylcyclohexanecarboxylic acid
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4-Methylcyclohexanecarboxylic acid
structure -
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CAS No:
4331-54-8
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Formula:
C8H14O2
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Chemical Name:
4-Methylcyclohexanecarboxylic acid
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Synonyms:
Cyclohexanecarboxylic acid,4-methyl-;4-Methylcyclohexanecarboxylic acid;p-Methylcyclohexanecarboxylic acid
- Categories:
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CAS No:
4-Methylcyclohexanecarboxylic acid Basic Attributes
142.2
142.20
213-289-5
70F0I2AMTV|M7DSK28350
124039
DTXSID80195822|DTXSID20274140|DTXSID20274145
2916209090
Characteristics
37.3
2.1
1.0140 g/cm3 @ Temp: 16 °C
110 °C
134-136 °C @ Press: 15 Torr
110.7±13.1 °C
1.467
Safety Information
NONH for all modes of transport
2
R22;R36
S26
Xn: Harmful;
P305 + P351 + P338
H302-H319
|Warning|H315 (100%): 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 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H302 (97.44%): 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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:142.20
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:142.099379685
Monoisotopic Mass:142.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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