1-chloro-2-methoxybenzene

C7H7ClO — CID 13011

IUPAC1-chloro-2-methoxybenzene
SMILESCOc1ccccc1Cl
InChIInChI=1S/C7H7ClO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIKeyQGRPVMLBTFGQDQ-UHFFFAOYSA-N
MW142.58 g/mol
LogP2.35
Rot. Bonds1

About 1-chloro-2-methoxybenzene

1-chloro-2-methoxybenzene (PubChem CID 13011) has the molecular formula C7H7ClO and a molecular weight of 142.58 g/mol. Its IUPAC name is 1-chloro-2-methoxybenzene.

Molecular Properties

Compound Name1-chloro-2-methoxybenzene
PubChem CID13011
Molecular FormulaC7H7ClO
Molecular Weight142.58 g/mol
Exact Mass142.02
IUPAC Name1-chloro-2-methoxybenzene
SMILESCOc1ccccc1Cl
InChIInChI=1S/C7H7ClO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIKeyQGRPVMLBTFGQDQ-UHFFFAOYSA-N
XLogP2.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.58
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-2-(trideuteriomethoxy)benzene
CID 162343627
2-[2-(2-chlorophenoxy)ethoxy]-1,3-dimethoxybenzene
CID 2283961
azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
2-chloro-6-methoxybenzenethiol
CID 91874124
1-chloro-2-fluoro-3-methoxybenzene;methane
CID 142301090
2-chloro-1-methoxy-3-methylbenzene;1-chloro-2-methylbenzene;ethane
CID 166081294
1,2-dichloro-3-(2,6-dimethoxyphenoxy)benzene
CID 173291827
4-[(2-chlorophenoxy)methyl]-1,2-dimethoxybenzene
CID 64763618
[(2,3-dichlorophenyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105191174
(2-chlorophenyl)methyl-[(2-methoxyphenyl)methyl]azanium
CID 7827742
2,3-dichloro-N-(2-methoxyphenyl)aniline
CID 82537063

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-methoxybenzene?
The IUPAC name of 1-chloro-2-methoxybenzene (CID 13011) is 1-chloro-2-methoxybenzene.
What is the SMILES notation for 1-chloro-2-methoxybenzene?
The canonical SMILES for 1-chloro-2-methoxybenzene is COc1ccccc1Cl.
What is the InChIKey of 1-chloro-2-methoxybenzene?
The InChIKey is QGRPVMLBTFGQDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3.
What are the key properties of 1-chloro-2-methoxybenzene?
1-chloro-2-methoxybenzene has a molecular weight of 142.58 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-methoxybenzene is sourced from PubChem (CID 13011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).