3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester
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3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester
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CAS No:
2611-00-9
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Formula:
C14H20O2
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Chemical Name:
3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester
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Synonyms:
3-Cyclohexene-1-carboxylic acid,3-cyclohexen-1-ylmethyl ester;3-Cyclohexenylmethyl 3-cyclohexenecarboxylate;Diene 221;3-Cyclohexen-1-ylmethyl 3-cyclohexenecarboxylate;1,2,5,6-Tetrahydrobenzyl 1,2,5,6-tetrahydrobenzoate;NSC 49615;3-Cyclohexenylmethyl 3′-cyclohexene-1-carboxylate;3-Cyclohexenylmethyl 3-cyclohexene-1-carboxylate;3-Cyclohexene-1-carboxylic acid 3-cyclohexenylmethyl ester;(Cyclohex-3-en-1-yl)methyl cyclohex-3-ene-1-carboxylate
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CAS No:
3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester Basic Attributes
220.307
220.31
220-031-5
E31OX8KGAL
49615
DTXSID9027493
2916209090
Characteristics
26.30000
4.09
Colorless liquid
1.0±0.1 g/cm3
152-153 °C @ Press: 7 Torr
130.2±9.6 °C
1.508
0.000912mmHg at 25°C
Safety Information
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 70 companies from 2 notifications to the ECHA C&L Inventory.
3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester Use and Manufacturing
3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester: ACTIVE|TRADEMARK FOR A COMMERCIAL STEREOSPECIFIC POLYBUTADIENE RUBBER. /DIENE/
Computed Properties
Molecular Weight:220.31
XLogP3:3.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:220.146329876
Monoisotopic Mass:220.146329876
Topological Polar Surface Area:26.3
Heavy Atom Count:16
Complexity:291
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Cyclohexene-1-carboxylic acid, 3-cyclohexen-1-ylmethyl ester
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