(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene

C15H20O2 — CID 155713423

IUPAC(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene
SMILESC=COc1c(C)c(C)c2c(c1C)CC[C@H](C)O2
InChIInChI=1S/C15H20O2/c1-6-16-14-10(3)11(4)15-13(12(14)5)8-7-9(2)17-15/h6,9H,1,7-8H2,2-5H3/t9-/m0/s1
InChIKeyMCZVNAHNKZSOEN-VIFPVBQESA-N
MW232.32 g/mol
LogP3.85
Rot. Bonds2

About (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene

(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene (PubChem CID 155713423) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene
PubChem CID155713423
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene
SMILESC=COc1c(C)c(C)c2c(c1C)CC[C@H](C)O2
InChIInChI=1S/C15H20O2/c1-6-16-14-10(3)11(4)15-13(12(14)5)8-7-9(2)17-15/h6,9H,1,7-8H2,2-5H3/t9-/m0/s1
InChIKeyMCZVNAHNKZSOEN-VIFPVBQESA-N
XLogP3.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-(methoxymethoxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene
CID 172845448
(2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-yl) 2-methylpropanoate
CID 176951971
2,5,7,8-tetramethyl-6-(5-methylhex-5-enoxy)-3,4-dihydro-2H-chromene
CID 142338753
(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene
CID 70422364
2,5,8-trimethyl-3,4-dihydro-2H-chromene
CID 167473800
2,5,7-trimethyl-3,4-dihydro-2H-thieno[3,4-b]pyran
CID 155032390
6-butoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene;(5E)-5-[(3,4-dimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione
CID 143852298
4-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoic acid;2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-ol
CID 173180702
14-hydroxy-6,6,9,13,15,16-hexamethyl-2,8-dioxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-7-one
CID 10427018
(2R)-5-bromo-2,4,6,7-tetramethyl-2,3-dihydro-1-benzofuran
CID 66759727
ethane;5-fluoro-8-methoxy-2-methyl-3,4-dihydro-2H-chromene
CID 142276557
4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]benzoic acid;2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-6-ol
CID 22220884

Frequently Asked Questions

What is the IUPAC name of (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene?
The IUPAC name of (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene (CID 155713423) is (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene?
The canonical SMILES for (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene is C=COc1c(C)c(C)c2c(c1C)CC[C@H](C)O2.
What is the InChIKey of (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene?
The InChIKey is MCZVNAHNKZSOEN-VIFPVBQESA-N. The full InChI is InChI=1S/C15H20O2/c1-6-16-14-10(3)11(4)15-13(12(14)5)8-7-9(2)17-15/h6,9H,1,7-8H2,2-5H3/t9-/m0/s1.
What are the key properties of (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene?
(2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene has a molecular weight of 232.32 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-6-ethenoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 155713423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).