6-phenylmethoxy-4H-1,3-dioxine

C11H12O3 — CID 174881803

IUPAC6-phenylmethoxy-4H-1,3-dioxine
SMILESC1=C(OCc2ccccc2)OCOC1
InChIInChI=1S/C11H12O3/c1-2-4-10(5-3-1)8-13-11-6-7-12-9-14-11/h1-6H,7-9H2
InChIKeyYZJCENLCZRWORS-UHFFFAOYSA-N
MW192.21 g/mol
LogP2.05
Rot. Bonds3

About 6-phenylmethoxy-4H-1,3-dioxine

6-phenylmethoxy-4H-1,3-dioxine (PubChem CID 174881803) has the molecular formula C11H12O3 and a molecular weight of 192.21 g/mol. Its IUPAC name is 6-phenylmethoxy-4H-1,3-dioxine.

Molecular Properties

Compound Name6-phenylmethoxy-4H-1,3-dioxine
PubChem CID174881803
Molecular FormulaC11H12O3
Molecular Weight192.21 g/mol
Exact Mass192.08
IUPAC Name6-phenylmethoxy-4H-1,3-dioxine
SMILESC1=C(OCc2ccccc2)OCOC1
InChIInChI=1S/C11H12O3/c1-2-4-10(5-3-1)8-13-11-6-7-12-9-14-11/h1-6H,7-9H2
InChIKeyYZJCENLCZRWORS-UHFFFAOYSA-N
XLogP2.05
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-phenylmethoxyphenyl) hypobromite
CID 151898979
5-phenylmethoxy-2,3-dihydro-1H-pyrrole
CID 141242168
1-iodo-3,5-bis(phenylmethoxy)benzene
CID 15389195
1-bromo-4-phenylmethoxybenzene;oxolane
CID 175495084
4-phenylmethoxy-1,3-benzodioxole
CID 14180566
14,15-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxymethyl]-2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene
CID 102077077
17,18-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxymethyl]-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
CID 102077079
14,15-bis[[3,5-bis(phenylmethoxy)phenyl]methoxymethyl]-2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene
CID 102077073
2-iodo-5-phenylmethoxypyrimidine
CID 153056979
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
3-hydroxy-4-(4-phenylmethoxyphenyl)-2H-furan-5-one
CID 67894059
5-phenylmethoxy-2H-pyran
CID 91151292

Frequently Asked Questions

What is the IUPAC name of 6-phenylmethoxy-4H-1,3-dioxine?
The IUPAC name of 6-phenylmethoxy-4H-1,3-dioxine (CID 174881803) is 6-phenylmethoxy-4H-1,3-dioxine.
What is the SMILES notation for 6-phenylmethoxy-4H-1,3-dioxine?
The canonical SMILES for 6-phenylmethoxy-4H-1,3-dioxine is C1=C(OCc2ccccc2)OCOC1.
What is the InChIKey of 6-phenylmethoxy-4H-1,3-dioxine?
The InChIKey is YZJCENLCZRWORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O3/c1-2-4-10(5-3-1)8-13-11-6-7-12-9-14-11/h1-6H,7-9H2.
What are the key properties of 6-phenylmethoxy-4H-1,3-dioxine?
6-phenylmethoxy-4H-1,3-dioxine has a molecular weight of 192.21 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenylmethoxy-4H-1,3-dioxine is sourced from PubChem (CID 174881803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).