Name: 3,4-dihydro-2H-benzo[b][1,4]oxazine-8-carboxylic acid
SMILES:
O=C(O)c1cccc2c1OCCN2Molecular Processing
Molecular formula
C9H9NO3
Molecular weight
179.17
Exact mass
179.0582
XLogP
1.19
TPSA
58.56
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
47.39
Supplementary Information
Details werden geladen…
An 4 Reaktionen beteiligt→