2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene

C16H17ClO3 — CID 59303411

IUPAC2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene
SMILESCOc1cc(C)cc(OC)c1OCc1cccc(Cl)c1
InChIInChI=1S/C16H17ClO3/c1-11-7-14(18-2)16(15(8-11)19-3)20-10-12-5-4-6-13(17)9-12/h4-9H,10H2,1-3H3
InChIKeyFLGIWVLRODRWGL-UHFFFAOYSA-N
MW292.76 g/mol
LogP4.24
Rot. Bonds5

About 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene

2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene (PubChem CID 59303411) has the molecular formula C16H17ClO3 and a molecular weight of 292.76 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene.

Molecular Properties

Compound Name2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene
PubChem CID59303411
Molecular FormulaC16H17ClO3
Molecular Weight292.76 g/mol
Exact Mass292.09
IUPAC Name2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene
SMILESCOc1cc(C)cc(OC)c1OCc1cccc(Cl)c1
InChIInChI=1S/C16H17ClO3/c1-11-7-14(18-2)16(15(8-11)19-3)20-10-12-5-4-6-13(17)9-12/h4-9H,10H2,1-3H3
InChIKeyFLGIWVLRODRWGL-UHFFFAOYSA-N
XLogP4.24
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.76
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-chlorophenyl)methoxy]-3,5-dimethoxybenzoic acid
CID 59303396
5-(bromomethyl)-1,3-dimethoxy-2-[(3-methylphenyl)methoxy]benzene
CID 43516816
4-[(3-chlorophenyl)methoxy]-3-iodo-5-methoxybenzaldehyde
CID 4770099
1-chloro-3-[(4-methoxyphenoxy)methyl]benzene
CID 112788879
(NE)-N-[[3-bromo-4-[(3-chlorophenyl)methoxy]-5-methoxyphenyl]methylidene]hydroxylamine
CID 6898200
1-[4-[(3-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]-N-(2,5-dimethylphenyl)methanimine
CID 126225931
1-[4-[(3-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]-N-(2,4-dimethylphenyl)methanimine
CID 126223175
[4-[(3-chlorophenyl)methoxy]-3,5-dimethylphenyl]methanol
CID 28933245
N-[[3-bromo-4-[(3-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-3-chloroaniline
CID 5135171
2-[(3-chlorophenyl)methoxy]-6-methoxybenzonitrile
CID 53423180
N-[[3-bromo-4-[(3-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-5-chloro-2-methylaniline
CID 126116027
2-[(3-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide
CID 82240842

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene?
The IUPAC name of 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene (CID 59303411) is 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene.
What is the SMILES notation for 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene?
The canonical SMILES for 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene is COc1cc(C)cc(OC)c1OCc1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene?
The InChIKey is FLGIWVLRODRWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO3/c1-11-7-14(18-2)16(15(8-11)19-3)20-10-12-5-4-6-13(17)9-12/h4-9H,10H2,1-3H3.
What are the key properties of 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene?
2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene has a molecular weight of 292.76 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)methoxy]-1,3-dimethoxy-5-methylbenzene is sourced from PubChem (CID 59303411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).