Diphenoxymethane

HCID 78183

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Basic information

CAS: 4442-41-5
Standard SMILES: c1ccc(OCOc2ccccc2)cc1
InChIKey: VTXLTXPNXYLCQD-UHFFFAOYSA-N
Molecular formula: C13H12O2
Average molar mass: 200.23 g/mol
Monoisotopic mass: 200.08372962

Names & identifiers

Preferred name: Diphenoxymethane
IUPAC: phenoxymethoxybenzene
English name: Diphenoxymethane
Molecular formula: C13H12O2
Molecular weight: 200.23

Names & synonyms

Diphenoxymethane4442-41-51,1'-(Methylenebis(oxy))bisbenzeneDTXSID30196167RefChem:1083771DTXCID40118658224-669-5phenoxymethoxybenzeneMFCD00191642(Phenoxymethoxy)benzeneEINECS 224-669-5phenoxy methoxybenzene

Show more names

Diphenoxymethane>(Methylenebisoxy)bisbenzene1,1'-[methylenebis(oxy)]bisbenzeneBenzene, 1,1'-[methylenebis(oxy)]bis-Formaldehyde Diphenyl Acetal Methylene Glycol Diphenyl Ether

(Phenoxymethoxy)benzene #4-(Phenoxy)methoxybenzeneFormaldehyde Diphenyl AcetalSCHEMBL497461Methylene Glycol Diphenyl EtherSCHEMBL2150076SCHEMBL2150312SCHEMBL5808046

Database identifiers

CAS: 4442-41-5
PubChem CID: 78183
DTXSID: DTXSID30196167
EC Number: 224-669-5
Nikkaji: J205.825A

Properties

Computed structural properties

XLogP: 3.9
Topological polar surface area: 18.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 15
Formal charge: 0
Complexity: 140

Physicochemical properties

Melting point: 15 °C · 15°C
Boiling point: 122 °C · 122 °C / 1.6mmHg
Density: 1 · 1,11 g/cm3
refractive index: 1.567 · 1.5670-1.5690
Flash point: 15 °C · 15 °C
form: clear liquid
color: Colorless to Light yellow
CAS DataBase Reference: 4442 · 4442-41-5
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety Statements: 22 · 22-24/25
HS Code: 2909.3 · 2909.30.6000