6-chloro-2-phenyl-3,4-dihydro-2H-chromene

C15H13ClO — CID 13250352

IUPAC6-chloro-2-phenyl-3,4-dihydro-2H-chromene
SMILESClc1ccc2c(c1)CCC(c1ccccc1)O2
InChIInChI=1S/C15H13ClO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-5,7,9-10,14H,6,8H2
InChIKeyJUCKELREIXLBHK-UHFFFAOYSA-N
MW244.72 g/mol
LogP4.41
Rot. Bonds1

About 6-chloro-2-phenyl-3,4-dihydro-2H-chromene

6-chloro-2-phenyl-3,4-dihydro-2H-chromene (PubChem CID 13250352) has the molecular formula C15H13ClO and a molecular weight of 244.72 g/mol. Its IUPAC name is 6-chloro-2-phenyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name6-chloro-2-phenyl-3,4-dihydro-2H-chromene
PubChem CID13250352
Molecular FormulaC15H13ClO
Molecular Weight244.72 g/mol
Exact Mass244.07
IUPAC Name6-chloro-2-phenyl-3,4-dihydro-2H-chromene
SMILESClc1ccc2c(c1)CCC(c1ccccc1)O2
InChIInChI=1S/C15H13ClO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-5,7,9-10,14H,6,8H2
InChIKeyJUCKELREIXLBHK-UHFFFAOYSA-N
XLogP4.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 7107
6-Chloro-2-(4-chlorophenyl)-3,4-dihydro-2H-1-benzopyran
CID 126331
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CID 16217683
Flavan
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4-Chloro-2-methylanisole
CID 76748
Benzene, 1-chloro-4-(phenylmethoxy)-
CID 139062
1-Chloro-4-((4-iodobenzyl)oxy)benzene
CID 65489731
3-benzyl-3,4-dihydro-2H-chromene
CID 15331838
6-Chloroflavanone
CID 236618
Isoflavan
CID 500472
6-chloro-4-phenyl-2H-chromen-2-one
CID 46919141
5-Chloro-2,3-dihydro-1-benzofuran
CID 592964

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-phenyl-3,4-dihydro-2H-chromene?
The IUPAC name of 6-chloro-2-phenyl-3,4-dihydro-2H-chromene (CID 13250352) is 6-chloro-2-phenyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 6-chloro-2-phenyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 6-chloro-2-phenyl-3,4-dihydro-2H-chromene is Clc1ccc2c(c1)CCC(c1ccccc1)O2.
What is the InChIKey of 6-chloro-2-phenyl-3,4-dihydro-2H-chromene?
The InChIKey is JUCKELREIXLBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO/c16-13-7-9-15-12(10-13)6-8-14(17-15)11-4-2-1-3-5-11/h1-5,7,9-10,14H,6,8H2.
What are the key properties of 6-chloro-2-phenyl-3,4-dihydro-2H-chromene?
6-chloro-2-phenyl-3,4-dihydro-2H-chromene has a molecular weight of 244.72 g/mol, XLogP of 4.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-phenyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 13250352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).