Nom: methyl 5-formyl-2-methoxycyclopentene-1-carboxylate
SMILES:
COC1=C(C(CC1)C=O)C(=O)OCMolecular Processing
Molecular formula
C9H12O4
Molecular weight
184.19
Exact mass
184.0736
XLogP
0.67
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
44.84
Supplementary Information
InChIKey: TXQSORVFZBOFMH-UHFFFAOYSA-N
Synonymes
TXQSORVFZBOFMH-UHFFFAOYSA-Nmethyl (5RS) 2-methoxy-5-formyl-1-cyclopentene-carboxylatemethyl (5RS) 2-methoxy-5-formyl-1-cyclopentenecarboxylate
Impliqué dans 5 réactions→