23W

methyl 2-(hydroxymethyl)prop-2-enoate

Created:	2013-08-26
Last modified:	2021-03-01

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1 entries where 23W is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	15
Aromatic Bond Count	0

2D diagram of 23W

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Chemical Component Summary
Name	methyl 2-(hydroxymethyl)prop-2-enoate
Synonyms	methyl 2-(hydroxymethyl)acrylate
Systematic Name (OpenEye OEToolkits)	methyl 2-(hydroxymethyl)prop-2-enoate
Formula	C₅ H₈ O₃
Molecular Weight	116.115
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(OC)/C(=C)CO
SMILES	CACTVS	3.385	COC(=O)C(=C)CO
SMILES	OpenEye OEToolkits	1.7.6	COC(=O)C(=C)CO
Canonical SMILES	CACTVS	3.385	COC(=O)C(=C)CO
Canonical SMILES	OpenEye OEToolkits	1.7.6	COC(=O)C(=C)CO
InChI	InChI	1.03	InChI=1S/C5H8O3/c1-4(3-6)5(7)8-2/h6H,1,3H2,2H3
InChIKey	InChI	1.03	RFUCOAQWQVDBEU-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	11815329
ChEMBL	CHEMBL1256639

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