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878-00-2

878-00-2 Structure

878-00-2 Structure
IdentificationMore
[Name]

4-ACETOXYBENZALDEHYDE
[CAS]

878-00-2
[Synonyms]

4-ACETOXYBENZALDEHYDE
4-FORMYLPHENYL ACETATE
ACETIC ACID 4-FORMYLPHENYL ESTER
ASINEX-REAG BAS 04292673
P-ACETOXYBENZALDEHYDE
P-FORMYLPHENYL ACETATE
TIMTEC-BB SBB008231
4-(acetyloxy)-benzaldehyd
Benzaldehyde, 4-(acetyloxy)-
Benzaldehyde, p-hydroxy-, acetate
p-Hydroxybenzaldehyde acetate
4-Acetoxybenzaldehyde 97%
4-ACETOXYBENZALDEHYDE, STABILIZED, 98%
4-(Acetyloxy)benzaldehyde
[EINECS(EC#)]

212-898-3
[Molecular Formula]

C9H8O3
[MDL Number]

MFCD00003384
[Molecular Weight]

164.16
[MOL File]

878-00-2.mol
Chemical PropertiesBack Directory
[Appearance]

Clear colorless to pale yellow liquid
[Melting point ]

213 °C
[Boiling point ]

152-153 °C/17 mmHg (lit.)
[density ]

1.168 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.538(lit.)
[Fp ]

>230 °F
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

clear liquid
[color ]

Colorless to Light yellow
[Specific Gravity]

1.168
[Sensitive ]

Air Sensitive
[BRN ]

1101359
[InChI]

1S/C9H8O3/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-6H,1H3
[InChIKey]

SEVSMVUOKAMPDO-UHFFFAOYSA-N
[SMILES]

CC(=O)Oc1ccc(C=O)cc1
[CAS DataBase Reference]

878-00-2(CAS DataBase Reference)
[EPA Substance Registry System]

Benzaldehyde, 4-(acetyloxy)- (878-00-2)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29153900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless to pale yellow liquid
[Uses]

4-Acetoxybenzaldehyde is used as pharmaceutical intermediate.
[Definition]

ChEBI: An acetate ester that is phenyl acetate substituted by a formyl group at position 4.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 50, p. 539, 1985 DOI: 10.1021/jo00204a025
[General Description]

The reductive amination of 4-acetoxybenzaldehyde (4-formylphenyl acetate) with an azanonaborane cluster in the presence of H3BNH2(CH2)4NH2 was studied.
Spectrum DetailBack Directory
[Spectrum Detail]

4-ACETOXYBENZALDEHYDE(878-00-2)MS
4-ACETOXYBENZALDEHYDE(878-00-2)1HNMR
4-ACETOXYBENZALDEHYDE(878-00-2)13CNMR
4-ACETOXYBENZALDEHYDE(878-00-2)IR1
4-ACETOXYBENZALDEHYDE(878-00-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Acetoxybenzaldehyde,stabilized,98%(878-00-2)
[Alfa Aesar]

4-Acetoxybenzaldehyde, 98%(878-00-2)
[Sigma Aldrich]

878-00-2(sigmaaldrich)
[TCI AMERICA]

4-Acetoxybenzaldehyde,>98.0%(GC)(878-00-2)
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