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2-(4-methylcyclohexylidene)aceticacid

2-(4-methylcyclohexylidene)aceticacid structure

CAS No:
77842-31-0
Formula:
C9H14O2
Chemical Name:
2-(4-methylcyclohexylidene)aceticacid
Synonyms:
2-(4-methylcyclohexylidene)acetic acid;(4-Methylcyclohexylidene)acetic acid;Acetic acid, 2-(4-methylcyclohexylidene)-

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2-(4-methylcyclohexylidene)aceticacid Basic Attributes

Molecular Weight：

154.21

Exact Mass：

154.099379685

DSSTox ID：

DTXSID90400217

Characteristics

Density：

1.05179 g/cm3

Melting Point：

70 °C

Boiling Point：

90-90.5 °C(Press: 3 Torr)

PKA：

4.25±0.41

Safety Information

GHS Classification：

|Warning|H315 (97.44%): 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 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:154.21
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:154.099379685
Monoisotopic Mass:154.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-methylcyclohexylidene)aceticacid

Basic Attributes
Characteristics
Safety Information
Computed Properties

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