6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]

C14H16Cl2O — CID 175151715

IUPAC6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]
SMILESClc1cc(Cl)c2c(c1)C1(CCCCC1)CCO2
InChIInChI=1S/C14H16Cl2O/c15-10-8-11-13(12(16)9-10)17-7-6-14(11)4-2-1-3-5-14/h8-9H,1-7H2
InChIKeyWYUBHYCPHDPEOH-UHFFFAOYSA-N
MW271.19 g/mol
LogP4.98
Rot. Bonds

About 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]

6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] (PubChem CID 175151715) has the molecular formula C14H16Cl2O and a molecular weight of 271.19 g/mol. Its IUPAC name is 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane].

Molecular Properties

Compound Name6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]
PubChem CID175151715
Molecular FormulaC14H16Cl2O
Molecular Weight271.19 g/mol
Exact Mass270.06
IUPAC Name6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]
SMILESClc1cc(Cl)c2c(c1)C1(CCCCC1)CCO2
InChIInChI=1S/C14H16Cl2O/c15-10-8-11-13(12(16)9-10)17-7-6-14(11)4-2-1-3-5-14/h8-9H,1-7H2
InChIKeyWYUBHYCPHDPEOH-UHFFFAOYSA-N
XLogP4.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.19
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] with MolForge

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Related Compounds

5,7-dichlorospiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 102168936
6-chloro-4,8-dimethyl-2,3-dihydrochromen-4-amine
CID 82194392
1-(5-chloro-8-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)cyclopentan-1-amine
CID 117422892
6-chloro-4-ethyl-8-methyl-2,3-dihydrochromen-4-amine
CID 82194427
1-methyl-2-(7-methylspiro[2,3-dihydrochromene-4,1'-cyclohexane]-8-yl)pyridin-1-ium
CID 140899479
1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)cyclopropan-1-ol
CID 117353948
1-[(4aS)-5,7-dichloro-1,2,3,4-tetrahydroxanthen-4a-yl]piperidin-1-ium
CID 6934760
1-(6-chloro-1,3-benzodioxol-4-yl)cyclopropan-1-ol
CID 117303319
6,8-dichloro-4-methyl-2,3-dihydro-1,4-benzoxazine
CID 82230773
6,8-dichlorospiro[3H-chromene-2,1'-cyclopentane]-4-one
CID 165352507
7-chlorospiro[1,2,3,4-tetrahydro-1-benzazepine-5,3'-oxolane]
CID 170250522
[1-(7-chloro-2,3-dihydro-1-benzofuran-5-yl)cyclohexyl]methanamine
CID 117418736

Frequently Asked Questions

What is the IUPAC name of 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]?
The IUPAC name of 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] (CID 175151715) is 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane].
What is the SMILES notation for 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]?
The canonical SMILES for 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] is Clc1cc(Cl)c2c(c1)C1(CCCCC1)CCO2.
What is the InChIKey of 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]?
The InChIKey is WYUBHYCPHDPEOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2O/c15-10-8-11-13(12(16)9-10)17-7-6-14(11)4-2-1-3-5-14/h8-9H,1-7H2.
What are the key properties of 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane]?
6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] has a molecular weight of 271.19 g/mol, XLogP of 4.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dichlorospiro[2,3-dihydrochromene-4,1'-cyclohexane] is sourced from PubChem (CID 175151715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).