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Methyl P-vinylbenzoate
ScientificNameLabel
Methyl P-vinylbenzoate
PHCD compound ID :
4571
Chemical Names :
Methyl P-vinylbenzoate
Molecular Formula :
C10H10O2
Molecular Weight :
162.06808
More Details :
Names & Synonyms:
methyl 4-vinylbenzoate , 4-ethenylbenzoic acid methyl ester , methyl 4-ethenylbenzoate , 4-vinylbenzoic acid methyl ester
Smiles:
COC(=O)c1ccc(cc1)C=C
InChi :
InChI=1S/C10H10O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h3-7H,1H2,2H3
InChi Key :
InChIKey=NUMHUJZXKZKUBN-UHFFFAOYSA-N
PubChem ID :
583124
Rotatable bond count :
3
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.762663
Hydrogen bond donor count :
0
Electric dipole moment :
2.362
XLogP :
2.158
VDW volume :
162.658006
Molecular weight :
162.06808
HOMO-LUMO gap :
9.013000
Herb list :
Wild garlic - Allium hirtifolium - موسیر
Refrences & Litretures:
703. Journal:'BioMed Research International' Year:'2013' Volume:'2013' Page:'1' DOI:'10.1155/2013/696835' Title:'Chemical Composition and Antibacterial and Cytotoxic Activities of Allium hirtifolium Boiss'
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