MWJ

4-bromo-2-methylphenol

Created:	2019-04-23
Last modified:	2019-09-25

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4 entries where MWJ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	16
Aromatic Bond Count	6

2D diagram of MWJ

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Chemical Component Summary
Name	4-bromo-2-methylphenol
Systematic Name (OpenEye OEToolkits)	4-bromanyl-2-methyl-phenol
Formula	C₇ H₇ Br O
Molecular Weight	187.034
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1cc(cc(C)c1O)Br
SMILES	CACTVS	3.385	Cc1cc(Br)ccc1O
SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(ccc1O)Br
Canonical SMILES	CACTVS	3.385	Cc1cc(Br)ccc1O
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(ccc1O)Br
InChI	InChI	1.03	InChI=1S/C7H7BrO/c1-5-4-6(8)2-3-7(5)9/h2-4,9H,1H3
InChIKey	InChI	1.03	IWJGMJHAIUBWKT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	16896
ChEMBL	CHEMBL224022

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