ChemicalBook--->CAS DataBase List--->534-59-8

534-59-8

534-59-8 Structure

534-59-8 Structure
IdentificationMore
[Name]

Butylmalonic acid
[CAS]

534-59-8
[Synonyms]

BUTYLMALONIC ACID
LABOTEST-BB LT00408941
N-BUTYLMALONIC ACID
RARECHEM DK HD C014
SALOR-INT L496251-1EA
1,1-Pentanedicarboxylic acid
2-Butylmalonate
2-Butylmalonic acid
2-n-Butylmalonic acid
alpha-Carboxycaproic acid
Butylmalonate
Malonic acid, butyl-
Propanedioic acid, butyl-
Butyl manonic acid
Butylmalonic
2-n-butylmalonate
2-Butylpropanedioic acid
Pentane-1,1-dicarboxylic acid
[EINECS(EC#)]

208-602-7
[Molecular Formula]

C7H12O4
[MDL Number]

MFCD00002673
[Molecular Weight]

160.17
[MOL File]

534-59-8.mol
Chemical PropertiesBack Directory
[Appearance]

WHITE CRYSTALLINE POWDER
[Melting point ]

105-107 °C (lit.)
[Boiling point ]

328.8°C (rough estimate)
[density ]

1.3681 (rough estimate)
[refractive index ]

1.4344 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

pK (5°): 2.96
[color ]

White to Almost white
[Water Solubility ]

438g/L(25 ºC)
[Merck ]

13,1575
[InChI]

1S/C7H12O4/c1-2-3-4-5(6(8)9)7(10)11/h5H,2-4H2,1H3,(H,8,9)(H,10,11)
[InChIKey]

MCRZWYDXIGCFKO-UHFFFAOYSA-N
[SMILES]

CCCCC(C(O)=O)C(O)=O
[CAS DataBase Reference]

534-59-8(CAS DataBase Reference)
[NIST Chemistry Reference]

Butylmalonic acid(534-59-8)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
[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
[HS Code ]

2917.19.7050
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Butylmalonic acid(534-59-8).msds
Hazard InformationBack Directory
[Chemical Properties]

white crystalline powder
Spectrum DetailBack Directory
[Spectrum Detail]

Butylmalonic acid(534-59-8)MS
Butylmalonic acid(534-59-8)1HNMR
Butylmalonic acid(534-59-8)13CNMR
Butylmalonic acid(534-59-8)IR1
Butylmalonic acid(534-59-8)IR2
Butylmalonic acid(534-59-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

534-59-8(sigmaaldrich)
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