324519-65-5
4-PENTENOIC ACID, 5-CHLORO-2-(1-METHYLETHYL)-, ETHYL ESTER, (4E)-
Name4-PENTENOIC ACID, 5-CHLORO-2-(1-METHYLETHYL)-, ETHYL ESTER, (4E)-
1Identification
【Name】
4-PENTENOIC ACID, 5-CHLORO-2-(1-METHYLETHYL)-, ETHYL ESTER, (4E)-
【CAS】
【MDL】
MFCD11113213
【English Synonyms】
【Formula】
C10 H17 Cl O2
【MolWeight】
204.695
【Inchi】
InChI=1S/C10H17ClO2/c1-4-13-10(12)9(8(2)3)6-5-7-11/h5,7-9H,4,6H2,1-3H3/b7-5+
【InChIKey】
InChIKey=KTYPEEJPWXCWGE-FNORWQNLSA-N
【SMILES】
CCOC(=O)C(C/C=C/Cl)C(C)C
【MOL File】
4-PENTENOIC ACID, 5-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-PENTENOIC ACID, 5-CHLORO-2-(1-METHYLETHYL)-, ETHYL ESTER, (4E)-.cml