(2,2-Diethoxyethoxy)benzene

HCID 96328

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Basic information

CAS: 32438-31-6
Standard SMILES: CCOC(COc1ccccc1)OCC
InChIKey: IISGAJPGMKEIAZ-UHFFFAOYSA-N
Molecular formula: C12H18O3
Average molar mass: 210.27 g/mol
Monoisotopic mass: 210.12559444

Names & identifiers

Preferred name: (2,2-Diethoxyethoxy)benzene
IUPAC: 2,2-diethoxyethoxybenzene
English name: (2,2-diethoxyethoxy)benzene
Molecular formula: C12H18O3
Molecular weight: 210.27

Names & synonyms

(2,2-Diethoxyethoxy)benzene32438-31-6Phenoxyacetaldehyde diethyl acetalBenzene, (2,2-diethoxyethoxy)-Acetaldehyde, phenoxy-, diethyl acetalEA07RN0YEL2-phenoxyacetaldehyde diethyl acetalEINECS 251-041-8NSC 67872NSC-678722,2-Diethoxyethoxy-benzene,AI3-05965

Show more names

SKL1165

DTXSID0067682ETHANE, 1,1-DIETHOXY-2-PHENOXY-RefChem:394351DTXCID9038509251-041-82,2-diethoxyethoxybenzeneMFCD00272279Phenoxy-acetaldehyde diethyl acetal

Database identifiers

CAS: 32438-31-6
PubChem CID: 96328
DTXSID: DTXSID0067682
UNII: EA07RN0YEL
EC Number: 251-041-8
Nikkaji: J319.383G

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 27.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 7
Heavy atoms: 15
Formal charge: 0
Complexity: 138

Physicochemical properties

solubility: Insoluble in water, soluble in alcohol and oils.
form: Colourless liquid.
Odor: Mild, green, oily-floral odor of good tenacity.
LogP: 2.742 · 2.742 (est)
FDA UNII: 7 RN0YEL · EA07RN0YEL
EPA Substance Registry System: Benzene, (2,2-diethoxyethoxy)- (32438-31-6)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Hazard Codes: Xi
TSCA: TSCA listed
HazardClass: IRRITANT

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

tsca: TSCA listed
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_class: IRRITANT
Hazard statements: H315-H319-H335
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362