COC(=O)C#CC(=O)OC
CAS: 762-42-5
Name: dimethyl but-2-ynedioate
SMILES: COC(=O)C#CC(=O)OC

Molecular Processing

Molecular formula
C6H6O4
Molecular weight
142.11
Exact mass
142.0266
XLogP
-0.66
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
31.81

Supplementary Information

InChIKey: VHILMKFSCRWWIJ-UHFFFAOYSA-N
Synonyme
Dimethyl acetylenedicarboxylate762-42-52-Butynedioic acid, dimethyl esterDimethyl 2-butynedioateBis(methoxycarbonyl)acetylene1,2-Bis(methoxycarbonyl)acetyleneDi(carbomethoxy)acetyleneAcetylenedicarboxylic acid dimethyl esterDimethyl ethynedicarboxylateAcetylenedicarboxylic acid, dimethyl ester1,2-Bis(methoxycarbonyl)ethyne7HZA2PL15FNSC-14912NSC-1011192-Butynedioic acid, 1,4-dimethyl esterDTXSID0061088RefChem:552497DTXCID7047857212-098-4dimethyl but-2-ynedioateDimethyl butynedioate1,4-dimethyl but-2-ynedioateBut-2-ynedioic acid dimethyl esterDMADMethyl acetylenedicarboxylateMFCD00008456Butynedioic acid dimethyl esterDimethylacetylenedicarboxylatedimethylacetylene dicarboxylatedimethyl acetylene dicarboxylate
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