10-[4-(2-ethylhexoxy)phenyl]phenoxazine

C26H29NO2 — CID 59130069

IUPAC10-[4-(2-ethylhexoxy)phenyl]phenoxazine
SMILESCCCCC(CC)COc1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C26H29NO2/c1-3-5-10-20(4-2)19-28-22-17-15-21(16-18-22)27-23-11-6-8-13-25(23)29-26-14-9-7-12-24(26)27/h6-9,11-18,20H,3-5,10,19H2,1-2H3
InChIKeyPSJVGYUURONPSQ-UHFFFAOYSA-N
MW387.52 g/mol
LogP7.86
Rot. Bonds8

About 10-[4-(2-ethylhexoxy)phenyl]phenoxazine

10-[4-(2-ethylhexoxy)phenyl]phenoxazine (PubChem CID 59130069) has the molecular formula C26H29NO2 and a molecular weight of 387.52 g/mol. Its IUPAC name is 10-[4-(2-ethylhexoxy)phenyl]phenoxazine.

Molecular Properties

Compound Name10-[4-(2-ethylhexoxy)phenyl]phenoxazine
PubChem CID59130069
Molecular FormulaC26H29NO2
Molecular Weight387.52 g/mol
Exact Mass387.22
IUPAC Name10-[4-(2-ethylhexoxy)phenyl]phenoxazine
SMILESCCCCC(CC)COc1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C26H29NO2/c1-3-5-10-20(4-2)19-28-22-17-15-21(16-18-22)27-23-11-6-8-13-25(23)29-26-14-9-7-12-24(26)27/h6-9,11-18,20H,3-5,10,19H2,1-2H3
InChIKeyPSJVGYUURONPSQ-UHFFFAOYSA-N
XLogP7.86
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.52
LogP ≤ 57.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-10-[4-(2-ethylhexoxy)phenyl]phenoxazine;10-[4-(2-ethylhexoxy)phenyl]-3-[10-[4-(2-ethylhexoxy)phenyl]phenoxazin-3-yl]phenoxazine
CID 157069986
10-(4-octoxyphenyl)phenoxazine
CID 58274116
1,4-bis[(2S)-2-ethylhexoxy]benzene
CID 67003802
2-ethylhexoxybenzene;methoxyboronic acid
CID 23293414
1-[(2E,4E)-3,4-dimethyl-5-phenylhexa-2,4-dien-2-yl]-4-(2-ethylhexoxy)benzene
CID 59296842
4-(2-ethylhexoxy)-N-methylaniline
CID 63423828
[4-(2-ethylhexoxy)phenyl]methanamine
CID 43126950
N-(4-bromophenyl)-4-[(2R)-2-ethylhexoxy]-N-[4-[(2R)-2-ethylhexoxy]phenyl]aniline
CID 98047352
10-[4-[4-[6-(4-butan-2-ylphenoxy)hexoxy]phenyl]sulfonylphenyl]phenoxazine
CID 155187506
1-[4-[[4-(2-ethylhexoxy)phenyl]diazenyl]phenyl]pyridin-4-one
CID 102504669
4-(2-ethylhexoxy)benzenediazonium
CID 101390113
2,6,9,10-tetrakis(2-ethylhexoxy)anthracene
CID 139930225

Frequently Asked Questions

What is the IUPAC name of 10-[4-(2-ethylhexoxy)phenyl]phenoxazine?
The IUPAC name of 10-[4-(2-ethylhexoxy)phenyl]phenoxazine (CID 59130069) is 10-[4-(2-ethylhexoxy)phenyl]phenoxazine.
What is the SMILES notation for 10-[4-(2-ethylhexoxy)phenyl]phenoxazine?
The canonical SMILES for 10-[4-(2-ethylhexoxy)phenyl]phenoxazine is CCCCC(CC)COc1ccc(N2c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of 10-[4-(2-ethylhexoxy)phenyl]phenoxazine?
The InChIKey is PSJVGYUURONPSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29NO2/c1-3-5-10-20(4-2)19-28-22-17-15-21(16-18-22)27-23-11-6-8-13-25(23)29-26-14-9-7-12-24(26)27/h6-9,11-18,20H,3-5,10,19H2,1-2H3.
What are the key properties of 10-[4-(2-ethylhexoxy)phenyl]phenoxazine?
10-[4-(2-ethylhexoxy)phenyl]phenoxazine has a molecular weight of 387.52 g/mol, XLogP of 7.86, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-(2-ethylhexoxy)phenyl]phenoxazine is sourced from PubChem (CID 59130069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).