7-chloro-3,4-dihydro-2H-chromen-3-ol

C9H9ClO2 — CID 15110076

IUPAC7-chloro-3,4-dihydro-2H-chromen-3-ol
SMILESOC1COc2cc(Cl)ccc2C1
InChIInChI=1S/C9H9ClO2/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8,11H,3,5H2
InChIKeyHMJXSHYDBLHOID-UHFFFAOYSA-N
MW184.62 g/mol
LogP1.64
Rot. Bonds

About 7-chloro-3,4-dihydro-2H-chromen-3-ol

7-chloro-3,4-dihydro-2H-chromen-3-ol (PubChem CID 15110076) has the molecular formula C9H9ClO2 and a molecular weight of 184.62 g/mol. Its IUPAC name is 7-chloro-3,4-dihydro-2H-chromen-3-ol.

Molecular Properties

Compound Name7-chloro-3,4-dihydro-2H-chromen-3-ol
PubChem CID15110076
Molecular FormulaC9H9ClO2
Molecular Weight184.62 g/mol
Exact Mass184.03
IUPAC Name7-chloro-3,4-dihydro-2H-chromen-3-ol
SMILESOC1COc2cc(Cl)ccc2C1
InChIInChI=1S/C9H9ClO2/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8,11H,3,5H2
InChIKeyHMJXSHYDBLHOID-UHFFFAOYSA-N
XLogP1.64
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.62
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-chloro-3,4-dihydro-2H-chromen-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-7-chloro-3,4-dihydro-2H-chromen-3-amine
CID 92966039
7-chloro-3-isocyanato-3,4-dihydro-2H-chromene
CID 115026637
6-chloro-2,3-dihydro-1-benzofuran-3-ol
CID 59606807
[(2R)-6-chloro-2,3-dihydro-1-benzofuran-2-yl]methanol
CID 101091624
(3R,4R)-4-amino-6-chloro-3,4-dihydro-2H-chromen-3-ol
CID 71517079
1-(6-chloro-2,3-dihydro-1-benzofuran-2-yl)ethanamine
CID 54124385
(4R)-7-chloro-3,4-dihydro-2H-chromen-4-ol
CID 79002138
(3S)-7-chloro-3-iodo-3,4-dihydro-2H-1,4-benzoxazine
CID 166788539
methyl (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate
CID 51514244
2-(7-chloro-3,4-dihydro-2H-1,2-benzoxazin-3-yl)acetic acid
CID 118627446
1-amino-6-chloro-2,3-dihydro-1H-inden-2-ol
CID 45043194
2-(6-chloro-2,3-dihydro-1-benzofuran-3-yl)acetic acid
CID 83754448

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3,4-dihydro-2H-chromen-3-ol?
The IUPAC name of 7-chloro-3,4-dihydro-2H-chromen-3-ol (CID 15110076) is 7-chloro-3,4-dihydro-2H-chromen-3-ol.
What is the SMILES notation for 7-chloro-3,4-dihydro-2H-chromen-3-ol?
The canonical SMILES for 7-chloro-3,4-dihydro-2H-chromen-3-ol is OC1COc2cc(Cl)ccc2C1.
What is the InChIKey of 7-chloro-3,4-dihydro-2H-chromen-3-ol?
The InChIKey is HMJXSHYDBLHOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClO2/c10-7-2-1-6-3-8(11)5-12-9(6)4-7/h1-2,4,8,11H,3,5H2.
What are the key properties of 7-chloro-3,4-dihydro-2H-chromen-3-ol?
7-chloro-3,4-dihydro-2H-chromen-3-ol has a molecular weight of 184.62 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3,4-dihydro-2H-chromen-3-ol is sourced from PubChem (CID 15110076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).