5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene

C12H14O — CID 643900

IUPAC5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene
SMILESC/C=C\Oc1ccc2c(c1)CCC2
InChIInChI=1S/C12H14O/c1-2-8-13-12-7-6-10-4-3-5-11(10)9-12/h2,6-9H,3-5H2,1H3/b8-2-
InChIKeyCRKIMQJUFWQMGT-WAPJZHGLSA-N
MW174.24 g/mol
LogP3.09
Rot. Bonds2

About 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene

5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene (PubChem CID 643900) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene
PubChem CID643900
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene
SMILESC/C=C\Oc1ccc2c(c1)CCC2
InChIInChI=1S/C12H14O/c1-2-8-13-12-7-6-10-4-3-5-11(10)9-12/h2,6-9H,3-5H2,1H3/b8-2-
InChIKeyCRKIMQJUFWQMGT-WAPJZHGLSA-N
XLogP3.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dihydro-1H-inden-5-yloxy)propanal
CID 126971637
bis(2,3-dihydro-1H-inden-5-yloxy)-oxophosphanium
CID 23365116
3-(2,3-dihydro-1H-inden-5-yloxy)butan-2-amine
CID 61354580
2-(2,3-dihydro-1H-inden-5-yloxy)-N-methylethanamine
CID 14809522
5-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 174495495
6-prop-1-enoxynaphthalene-2-carboxylic acid
CID 57123185
4-(2,3-dihydro-1H-inden-5-yloxy)pyridine
CID 57051000
2-(2,3-dihydro-1H-inden-5-yloxy)-3-methylbutanamide
CID 82041277
3-(2,3-dihydro-1H-inden-5-yloxy)propyl-dimethylazanium
CID 7380399
6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalene
CID 82076236
2,3-dihydro-1H-inden-5-yl(methyl)phosphane
CID 166765360
methyl 2-(2,3-dihydro-1H-inden-5-yloxy)acetate
CID 43082820

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene?
The IUPAC name of 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene (CID 643900) is 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene?
The canonical SMILES for 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene is C/C=C\Oc1ccc2c(c1)CCC2.
What is the InChIKey of 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene?
The InChIKey is CRKIMQJUFWQMGT-WAPJZHGLSA-N. The full InChI is InChI=1S/C12H14O/c1-2-8-13-12-7-6-10-4-3-5-11(10)9-12/h2,6-9H,3-5H2,1H3/b8-2-.
What are the key properties of 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene?
5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene has a molecular weight of 174.24 g/mol, XLogP of 3.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-prop-1-enoxy]-2,3-dihydro-1H-indene is sourced from PubChem (CID 643900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).