4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID

CAS No.
5333-34-6 ;60890-29-1
CCD No.
CCD00022413
Formula
C12 H14 O5
MolWeight
238.238

Basic Information

Product Name: 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID
CAS: 5333-34-6 ;60890-29-1
English Synonyms: 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTANOIC ACID ; 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYRIC ACID ; 3-(3,4-DIMETHOXYBENZOYL)PROPIONIC ACID ; 4-(3,4-DIMETHOXYPHENYL)-4-OXOBUTYROIC ACID ; 3,4-DIMETHOXY-4-OXO-BENZENEBUTANOIC ACID
MDL Number.: MFCD00033286
H bond acceptor: 5
H bond donor: 1
Smile: COc1ccc(cc1OC)C(=O)CCC(=O)O
InChi: InChI=1S/C12H14O5/c1-16-10-5-3-8(7-11(10)17-2)9(13)4-6-12(14)15/h3,5,7H,4,6H2,1-2H3,(H,14,15)
InChiKey: InChIKey=BUAYFJKMVBIPKA-UHFFFAOYSA-N

Property

Melting Point: 159-161 DEG C/37℃
Comments: HAZARD: R 36/37/38
HAZARD: S 26-37
IRRITANT
TSCA: N
UNSPSC: 12352103

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H315,H319
Precautionary statements: P305+P351+P338
hazard symbol: Xi
Risk Code: R:R36/38
Safe Code: S:S26;S36/37
WGK Germany: 3

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