이름: 8-chlorodibenz[b,f][1,4]oxazepine-10(11H)-carboxylic acid
SMILES:
O=C(O)N1Cc2ccccc2Oc2ccc(Cl)cc21Molecular Processing
Molecular formula
C14H10ClNO3
Molecular weight
275.69
Exact mass
275.0349
XLogP
4.13
TPSA
49.77
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
72.18
Supplementary Information
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