Methoxyacetaldehyde

HCID 91563

Basic information

CAS
10312-83-1
Standard SMILES
COCC=O
InChIKey
YSEFYOVWKJXNCH-UHFFFAOYSA-N
Molecular formula
C3H6O2
Average molar mass
74.08 g/mol
Monoisotopic mass
74.03677943

Overview

shows testicular toxicity; structure given in first source

Names & identifiers

Preferred name
Methoxyacetaldehyde
IUPAC
2-methoxyacetaldehyde
English name
Methoxyacetaldehyde
Molecular formula
C3H6O2
Molecular weight
74.08

Names & synonyms

Methoxyacetaldehyde2-Methoxyacetaldehyde10312-83-1Acetaldehyde, methoxy-5G4O7K64WADTXSID90145651MALD cpdRefChem:157057DTXCID1068142233-693-5Methoxyethanal2-methoxyethanal
Show more names
methoxy-acetaldehyd2-methoxy-acetaldehyd
Acetaldehyde, 2-methoxy-MFCD00059176.alpha.-Methoxyacetaldehydemethoxy acetaldehydeCCRIS 6517EINECS 233-693-5BRN 1738030UNII-5G4O7K64WA

Database identifiers

CAS
10312-83-1
PubChem CID
91563
DTXSID
DTXSID90145651
UNII
5G4O7K64WA
EC Number
233-693-5
Nikkaji
J54.041B

Properties

Computed structural properties

XLogP
-0.4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
5

Experimental & physicochemical properties

SpringerMaterials PropertiesCoriolis coupling

Physicochemical properties

Boiling point
99 · 99-101℃
Density
0.906 · 0.906±0.06 g/cm3 (20 ºC 760 Torr)
refractive index
1.395 · 1.3950 (589.3 nm 20℃)
Flash point
-38.9 · -38.9±13.4℃
LogP
-0.64 · -0.640 (est)
EWG's Food Scores
1 · 1

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H225 (97.4%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P303+P361+P353, P305+P351+P338, P317, P321, P330, P333+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationChemical: Acetaldehyde, methoxy-
Hazard Classes and CategoriesFlam. Liq. 2 (97.4%)

Safety data

rtecs
AB2940000
ridadr
1993
risk_code
11-36/37/38-43-36-22
Signal word
Danger
Symbol(GHS)
GHS02,GHS07
hazard_code
Xn

Chemistry & industry

Suppliers26 total

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
Additional notes · 1 item

DefinitionA highly reactive aldehyde derivative available in 77% aqueous solution. Clear colorless liquid with odor characteristic of lower aldehydes, miscible with water and many organic solvents. Resembles butyraldehyde in structure and some properties. Claimed as possible antimicrobial agent, preservative, and polymer modifier.

Related reactions

55 records

Compound notes

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