2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol

C10H11ClO3 — CID 84783596

IUPAC2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1cc(C2(O)CC2)cc(O)c1Cl
InChIInChI=1S/C10H11ClO3/c1-14-8-5-6(10(13)2-3-10)4-7(12)9(8)11/h4-5,12-13H,2-3H2,1H3
InChIKeyBDEOPIQMGCPGEC-UHFFFAOYSA-N
MW214.65 g/mol
LogP2.04
Rot. Bonds2

About 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol

2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol (PubChem CID 84783596) has the molecular formula C10H11ClO3 and a molecular weight of 214.65 g/mol. Its IUPAC name is 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol.

Molecular Properties

Compound Name2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol
PubChem CID84783596
Molecular FormulaC10H11ClO3
Molecular Weight214.65 g/mol
Exact Mass214.04
IUPAC Name2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1cc(C2(O)CC2)cc(O)c1Cl
InChIInChI=1S/C10H11ClO3/c1-14-8-5-6(10(13)2-3-10)4-7(12)9(8)11/h4-5,12-13H,2-3H2,1H3
InChIKeyBDEOPIQMGCPGEC-UHFFFAOYSA-N
XLogP2.04
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[1-(aminomethyl)cyclopropyl]-2-chloro-3-methoxyphenol
CID 84791834
1-(3-chloro-5-methoxy-4-methylphenyl)cyclopropan-1-ol
CID 117303343
2-chloro-3-(1-hydroxycyclopropyl)-4,5-dimethoxyphenol
CID 117363638
4-chloro-3-fluoro-2-(1-hydroxycyclopropyl)-5-methoxyphenol
CID 84795728
1-(3-chloro-4-ethyl-5-methoxyphenyl)cyclopropan-1-ol
CID 117326102
4-chloro-5-methoxybenzene-1,3-diol
CID 130033872
1-[3,5-dimethoxy-4-(methoxymethyl)phenyl]cyclopropan-1-ol
CID 117349197
3-chloro-2-(1-hydroxycyclopropyl)-4,5-dimethoxyphenol
CID 117363639
8-(4-chloro-3-methoxyphenyl)spiro[4.5]decan-8-ol
CID 114819278
2,4-dichloro-3,5-dimethoxyphenol
CID 154103285
1-(2-chloro-3-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
CID 117354231
1-(4-methoxy-3,5-dimethylphenyl)cyclopropan-1-ol
CID 117283028

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol?
The IUPAC name of 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol (CID 84783596) is 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol.
What is the SMILES notation for 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol?
The canonical SMILES for 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol is COc1cc(C2(O)CC2)cc(O)c1Cl.
What is the InChIKey of 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol?
The InChIKey is BDEOPIQMGCPGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO3/c1-14-8-5-6(10(13)2-3-10)4-7(12)9(8)11/h4-5,12-13H,2-3H2,1H3.
What are the key properties of 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol?
2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol has a molecular weight of 214.65 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(1-hydroxycyclopropyl)-3-methoxyphenol is sourced from PubChem (CID 84783596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).