COC(=O)C1CC2C=CC1O2
CAS: 21987-33-7
Название: methyl 7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylate
SMILES: COC(=O)C1CC2C=CC1O2

Molecular Processing

Molecular formula
C8H10O3
Molecular weight
154.16
Exact mass
154.063
XLogP
0.5
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
37.92

Supplementary Information

InChIKey: OZONFNLDQRXRGI-UHFFFAOYSA-N
Синонимы
methyl 7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylatemethyl 7-oxabicyclo(2.2.1)hept-5-ene-2-carboxylateRefChem:817514832-706-721987-33-77-Oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid, methyl estermethyl 7-oxa-5-norbornen-2-carboxylateMFCD24499834MFCD32670547starbld0027456methyl endo-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylateSCHEMBL2960975DTXSID50483460OZONFNLDQRXRGI-UHFFFAOYSA-N17791-33-2WAA98733204988-60-3AS-79140SY344230D79375EN300-2172232-carbomethoxy-7-oxabicyclo(2,2,1)hept-5-ene2-carbomethoxy-7-oxabicyclo(2.2.1)hept-5-enerac-methyl 7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylate
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