CITRONELLYL-3-METHYLBUT-2-ENOATE
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CITRONELLYL-3-METHYLBUT-2-ENOATE
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CAS No:
20770-40-5
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Formula:
C15H26O2
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Chemical Name:
CITRONELLYL-3-METHYLBUT-2-ENOATE
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Synonyms:
2-butenoicacid,3-methyl-,3,7-dimethyl-6-octenylester;SINODOR;Senecioic acid citronellyl ester;2-BUTENOIC ACID, 3-METHYL-, 3,7-DIMETHYL-6-OCTENYL ESTER,97+%;3,3-Dimethylacrylic acid 3,7-dimethyl-6-octenyl ester;Citronellol senecionate;CITRONELLYL SENECIONATE;2-Butenoic acid,3-Methyl-, 3,7-diMethyl-6-octen-1-yl ester
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CAS No:
Characteristics
26.3
4.26840
0.893±0.06 g/cm3(Predicted)
165 °C(Press: 2 Torr)
143.2ºC
1.459
0.000495mmHg at 25°C
at 100.00 %. very mild red rose geranium
CITRONELLYL-3-METHYLBUT-2-ENOATE Use and Manufacturing
Methyl crotonic acid citronellol, also known as citronellol tyrosine, is a colorless liquid that can be used in daily chemical fragrances.
2-Butenoic acid, 3-methyl-, 3,7-dimethyl-6-octen-1-yl ester: ACTIVE
Computed Properties
Molecular Weight:238.37
XLogP3:5.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:238.193280068
Monoisotopic Mass:238.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:279
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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CITRONELLYL-3-METHYLBUT-2-ENOATE
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