56909-02-5
6-HEPTYNOIC ACID, METHYL ESTER
Name
6-HEPTYNOIC ACID, METHYL ESTER
Formula
C8 H12 O2
MolWeight
140.181
1Identification
【Name】
6-HEPTYNOIC ACID, METHYL ESTER
【CAS】
【MDL】
MFCD18973944
【English Synonyms】
【Formula】
C8 H12 O2
【MolWeight】
140.181
【Inchi】
InChI=1S/C8H12O2/c1-3-4-5-6-7-8(9)10-2/h1H,4-7H2,2H3
【InChIKey】
InChIKey=SIAYBFIHWUHVRJ-UHFFFAOYSA-N
【SMILES】
COC(=O)CCCCC#C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-HEPTYNOIC ACID, METHYL ESTER.cml
Quick Release
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