Catalog Number |
ACM23326274-1 |
CAS |
23326-27-4 |
Structure |
|
IUPAC Name |
methyl but-2-ynoate |
Synonyms |
Methyl 2-butynoate;23326-27-4;methyl but-2-ynoate;Methyl tetrolate;2-Butynoic acid, methyl ester;2-Butynoic Acid Methyl Ester;Tetrolic Acid Methyl Ester;but-2-ynoic acid methyl ester;Methyl 2-butynoate, 97%;MFCD00009273;Methyl methylpropiolate;PubChem12783;ACMC-1CEIL;Methyl 3-methylpropiolate;METHYL-2-BUTYNOATE;2-Butynoic acid,methylester;Methyl methylacetylenecarboxylate;UJQCANQILFWSDJ-UHFFFAOYSA-;AMY1234;DTXSID90177876;ACT09348;ZINC1765591;ANW-25096;NSC244950;RW2063;AKOS009158656;NSC-244950;DB-046128;CS-0066219;FT-0628444;T1053;X7106 |
Molecular Weight |
98.10g/mol |
Molecular Formula |
C5H6O2 |
Canonical SMILES |
CC#CC(=O)OC |
InChI |
InChI=1S/C5H6O2/c1-3-4-5(6)7-2/h1-2H3 |
InChI Key |
UJQCANQILFWSDJ-UHFFFAOYSA-N |
Complexity |
124 |
Covalently-Bonded Unit Count |
1 |
Exact Mass |
98.036779430g/mol |
Heavy Atom Count |
7 |
Hydrogen Bond Acceptor Count |
2 |
Monoisotopic Mass |
98.036779430g/mol |
NSC Number |
244950 |
Rotatable Bond Count |
1 |
Topological Polar Surface Area |
26.3Ų |
X Log P3 |
1.1 |