(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol

C16H15ClO2 — CID 61082038

IUPAC(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
SMILESCC1Cc2cc(C(O)c3ccccc3Cl)ccc2O1
InChIInChI=1S/C16H15ClO2/c1-10-8-12-9-11(6-7-15(12)19-10)16(18)13-4-2-3-5-14(13)17/h2-7,9-10,16,18H,8H2,1H3
InChIKeyUXPWYZGRKRVCMS-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.75
Rot. Bonds2

About (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol

(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol (PubChem CID 61082038) has the molecular formula C16H15ClO2 and a molecular weight of 274.75 g/mol. Its IUPAC name is (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol.

Molecular Properties

Compound Name(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
PubChem CID61082038
Molecular FormulaC16H15ClO2
Molecular Weight274.75 g/mol
Exact Mass274.08
IUPAC Name(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
SMILESCC1Cc2cc(C(O)c3ccccc3Cl)ccc2O1
InChIInChI=1S/C16H15ClO2/c1-10-8-12-9-11(6-7-15(12)19-10)16(18)13-4-2-3-5-14(13)17/h2-7,9-10,16,18H,8H2,1H3
InChIKeyUXPWYZGRKRVCMS-UHFFFAOYSA-N
XLogP3.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-dichlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61081247
(4-chloro-2,5-difluorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
CID 82771936
(2-chlorophenyl)-(1,3-dihydro-2-benzofuran-5-yl)methanol
CID 63021648
(3-methoxyphenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61081834
1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-2-phenylbutan-1-ol
CID 61081250
1-(2-chloro-4-fluorophenyl)-N-methyl-1-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
CID 43487238
5-[bromo-(2-chloro-4-methylphenyl)methyl]-2-methyl-2,3-dihydro-1-benzofuran
CID 106863093
2-amino-2-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 82605121
5-[bromo-(2-methylcyclopropyl)methyl]-2-methyl-2,3-dihydro-1-benzofuran
CID 61096385
(2,5-dichlorothiophen-3-yl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine
CID 107960594
5-[chloro-(5-chloro-2-methylphenyl)methyl]-2-methyl-2,3-dihydro-1-benzofuran
CID 82890400
(R)-(2-chlorophenyl)-(4-methylphenyl)methanol
CID 7107251

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol?
The IUPAC name of (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol (CID 61082038) is (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol.
What is the SMILES notation for (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol?
The canonical SMILES for (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol is CC1Cc2cc(C(O)c3ccccc3Cl)ccc2O1.
What is the InChIKey of (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol?
The InChIKey is UXPWYZGRKRVCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClO2/c1-10-8-12-9-11(6-7-15(12)19-10)16(18)13-4-2-3-5-14(13)17/h2-7,9-10,16,18H,8H2,1H3.
What are the key properties of (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol?
(2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol has a molecular weight of 274.75 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanol is sourced from PubChem (CID 61082038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).