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trans-2-Methyl-2-pentenoic acid

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Name

trans-2-Methyl-2-pentenoic acid

EINECS 241-026-4
CAS No. 16957-70-3 Density 0.987 g/cm3
PSA 37.30000 LogP 1.42730
Solubility insoluble in water Melting Point 26-28 °C(lit.)
Formula C6H10O2 Boiling Point 215.903 °C at 760 mmHg
Molecular Weight 114.144 Flash Point 113.863 °C
Transport Information UN 3261 Appearance clear colorless to pale yellow liquid
Safety 26-36/37/39-45 Risk Codes 34
Molecular Structure Molecular Structure of 16957-70-3 (trans-2-Methyl-2-pentenoic acid) Hazard Symbols CorrosiveC
Synonyms

2-Pentenoicacid, 2-methyl-, (E)- (8CI);(E)-2-Methyl-2-pentenoic acid;(E)-2-Methyl-2-pentenoyl chloride;

Article Data 27

trans-2-Methyl-2-pentenoic acid Chemical Properties

Product Name: 2-Pentenoic acid,2-methyl-, (2E)- (CAS NO.16957-70-3)


Molecular Formula: C6H10O2
Molecular Weight: 114.14g/mol
Mol File: 16957-70-3.mol
EINECS: 241-026-4
Melting Point: 26-28 °C(lit.)
Boiling point: 215.9 °C at 760 mmHg
Flash Point: 113.9 °C
Density: 0.987 g/cm3
Refractive index: n20/D 1.46(lit.)
Surface Tension: 32.4 dyne/cm
Enthalpy of Vaporization: 49.83 kJ/mol
Vapour Pressure: 0.0554 mmHg at 25°C
XLogP3-AA: 1.4
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of 2-Pentenoic acid,2-methyl-, (2E)- (CAS NO.16957-70-3):
  IUPAC Name: (E)-2-methylpent-2-enoic acid
  Canonical SMILES: CCC=C(C)C(=O)O
  Isomeric SMILES: CC/C=C(\C)/C(=O)O
  InChI: InChI=1S/C6H10O2/c1-3-4-5(2)6(7)8/h4H,3H2,1-2H3,(H,7,8)/b5-4+ 
  InChIKey: JJYWRQLLQAKNAD-SNAWJCMRSA-N
Product Categories: C6; Carbonyl Compounds; Carboxylic Acids

trans-2-Methyl-2-pentenoic acid Safety Profile

Safety Information of 2-Pentenoic acid,2-methyl-, (2E)- (CAS NO.16957-70-3):
Hazard Codes: CCorrosive
Risk Statements: 34 
34:  Causes burns
Safety Statements: 26-36/37/39-45
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing  
37:  Wear suitable gloves   
39:  Wear eye/face protection 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
RIDADR: UN 3261 8/PG 3
WGK Germany: 2
HazardClass: 8
PackingGroup: III

trans-2-Methyl-2-pentenoic acid Specification

 2-Pentenoic acid,2-methyl-, (2E)- , its CAS NO. is 16957-70-3, the synonyms are EINECS 241-026-4 ; trans-2-Methyl-2-pentenoic acid ; (E)-2-Methylpent-2-en-1-oic acid .

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