O1J

(benzyloxy)acetic acid

Created:	2019-06-04
Last modified:	2019-08-21

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4 entries where O1J is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	6

2D diagram of O1J

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Chemical Component Summary
Name	(benzyloxy)acetic acid
Systematic Name (OpenEye OEToolkits)	2-phenylmethoxyethanoic acid
Formula	C₉ H₁₀ O₃
Molecular Weight	166.174
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1ccccc1COCC(=O)O
SMILES	CACTVS	3.385	OC(=O)COCc1ccccc1
SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)COCC(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)COCc1ccccc1
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1ccc(cc1)COCC(=O)O
InChI	InChI	1.03	InChI=1S/C9H10O3/c10-9(11)7-12-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)
InChIKey	InChI	1.03	GRZHHTYDZVRPIC-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	290301
ChEMBL	CHEMBL3247413

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