2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene

C20H22O2 — CID 10108511

IUPAC2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene
SMILESCC1=CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1
InChIInChI=1S/C20H22O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-10H,11-12H2,1-4H3
InChIKeyNDOGZWHXIIZROA-UHFFFAOYSA-N
MW294.39 g/mol
LogP5.03
Rot. Bonds3

About 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene

2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene (PubChem CID 10108511) has the molecular formula C20H22O2 and a molecular weight of 294.39 g/mol. Its IUPAC name is 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene.

Molecular Properties

Compound Name2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene
PubChem CID10108511
Molecular FormulaC20H22O2
Molecular Weight294.39 g/mol
Exact Mass294.16
IUPAC Name2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene
SMILESCC1=CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1
InChIInChI=1S/C20H22O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-10H,11-12H2,1-4H3
InChIKeyNDOGZWHXIIZROA-UHFFFAOYSA-N
XLogP5.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.39
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene
CID 70422364
2,5,7,8-tetramethyl-6-phenylmethoxy-2-prop-2-enyl-3,4-dihydrochromene
CID 14210609
N,N-dimethyl-2-(4,6,7-trimethyl-5-phenylmethoxy-2,3-dihydro-1-benzofuran-2-yl)ethanamine;hydrochloride
CID 19899205
N,N-dimethyl-2-[(2S)-4,6,7-trimethyl-5-phenylmethoxy-2,3-dihydro-1-benzofuran-2-yl]ethanamine;hydrochloride
CID 67795307
methyl 2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromene-2-carboxylate
CID 10570125
2,3,5,6-tetramethyl-4-phenylmethoxybenzaldehyde
CID 71408995
9-methyl-10-phenylmethoxy-1,2,3,4-tetrahydrophenanthrene
CID 71501787
2,4,5-trimethyl-3,6-bis(phenylmethoxy)benzaldehyde
CID 86653777
(2R)-2,5,7,8-tetramethyl-3-pent-1-ynyl-6-phenylmethoxy-3,4-dihydrochromen-2-ol
CID 70621879
2-[(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl]ethyl 4-methylbenzenesulfonate
CID 11225673
N-methyl-2-[2,4,5-trimethyl-3,6-bis(phenylmethoxy)phenyl]ethanamine
CID 86653767
3-(2,2,5,7-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-8-yl)propanal
CID 19877353

Frequently Asked Questions

What is the IUPAC name of 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene?
The IUPAC name of 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene (CID 10108511) is 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene.
What is the SMILES notation for 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene?
The canonical SMILES for 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene is CC1=CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1.
What is the InChIKey of 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene?
The InChIKey is NDOGZWHXIIZROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-10H,11-12H2,1-4H3.
What are the key properties of 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene?
2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene has a molecular weight of 294.39 g/mol, XLogP of 5.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene is sourced from PubChem (CID 10108511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).