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2174-58-5

2174-58-5 Structure

2174-58-5 Structure
IdentificationMore
[Name]

(S)-(-)-Methylsuccinic acid
[CAS]

2174-58-5
[Synonyms]

(S)-(-)-METHYLSUCCINIC ACID
(S)-(-)-PYROTARTARIC ACID
(s)-2-methylsuccinicacid
(S)2-Methylsuccinicacid
(S)-(-)-MethylsuccinicAcid(S)-(-)-
(S)-(-)-METHYLSUCCINIC ACID 98+%
(2S)-2-Methylbutanedioic acid
[Molecular Formula]

C5H8O4
[MDL Number]

MFCD00192321
[Molecular Weight]

132.11
[MOL File]

2174-58-5.mol
Chemical PropertiesBack Directory
[Melting point ]

110-115 °C(lit.)
[alpha ]

-8 º (c=5, H2O)
[Boiling point ]

236.5±13.0 °C(Predicted)
[density ]

1.311±0.06 g/cm3(Predicted)
[refractive index ]

-15.5 ° (C=2, EtOH)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

solid
[pka]

4.56±0.19(Predicted)
[color ]

White
[Optical Rotation]

[α]20/D -8.3°, c =5.1 in H2O
[InChI]

1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/t3-/m0/s1
[InChIKey]

WXUAQHNMJWJLTG-VKHMYHEASA-N
[SMILES]

C[C@@H](CC(O)=O)C(O)=O
[CAS DataBase Reference]

2174-58-5(CAS DataBase Reference)
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 .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[HS Code ]

2917198090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

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

White solid
[Definition]

ChEBI: (S)-methylsuccinic acid is a 2-methylbutanedioic acid in which the methyl group at position 2 has S-configuration. It is a conjugate acid of a (2S)-methylsuccinate(2-). It is an enantiomer of a (R)-methylsuccinic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-(-)-Methylsuccinic acid(2174-58-5)MS
(S)-(-)-Methylsuccinic acid(2174-58-5)1HNMR
(S)-(-)-Methylsuccinic acid(2174-58-5)13CNMR
(S)-(-)-Methylsuccinic acid(2174-58-5)IR1
(S)-(-)-Methylsuccinic acid(2174-58-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

2174-58-5(sigmaaldrich)
[TCI AMERICA]

(S)-(-)-Methylsuccinic Acid,>98.0%(T)(2174-58-5)
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