189640-37-7
2-CYANO-5-METHYL-2-(3-METHYLBUT-2-ENYL)HEX-4-ENOIC ACID
Name
2-CYANO-5-METHYL-2-(3-METHYLBUT-2-ENYL)HEX-4-ENOIC ACID
Formula
C13 H19 N O2
MolWeight
221.298
1Identification
【Name】
2-CYANO-5-METHYL-2-(3-METHYLBUT-2-ENYL)HEX-4-ENOIC ACID
【CAS】
【MDL】
MFCD02090602
【English Synonyms】
【Formula】
C13 H19 N O2
【MolWeight】
221.298
【Inchi】
InChI=1S/C13H19NO2/c1-10(2)5-7-13(9-14,12(15)16)8-6-11(3)4/h5-6H,7-8H2,1-4H3,(H,15,16)
【InChIKey】
InChIKey=SASKPRUTXWPBDF-UHFFFAOYSA-N
【SMILES】
CC(=CCC(CC=C(C)C)(C#N)C(=O)O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-CYANO-5-METHYL-2-(3-METHYLBUT-2-ENYL)HEX-4-ENOIC ACID.cml
Quick Release
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Catalog No:A1-2261 25G
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Business Type:Others
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Catalog No:920654 25G
Country/Region:United States
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Catalog No:C9948 nullnull
Country/Region:United States
Business Type:Others
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Country/Region:United States
Business Type:Others
http://www.acccorporation.com
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Country/Region:United States
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