이름: 3-chlorobenzo[b][1,4]benzoxazepine
SMILES:
C1=CC=C2C(=C1)C=NC3=C(O2)C=CC(=C3)ClMolecular Processing
Molecular formula
C13H8ClNO
Molecular weight
229.67
Exact mass
229.0294
XLogP
4.2
TPSA
21.59
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
65.22
Supplementary Information
InChIKey: RTQDEGQPODPWJO-UHFFFAOYSA-N
동의어
8-chloro-dibenz[b,f]-[1,4]oxazepineOprea1_370615Oprea1_823451SCHEMBL3526060RTQDEGQPODPWJO-UHFFFAOYSA-N8-chlorodibenz[b,f][1,4]oxazepine8-chloro-dibenz[b,f][1,4]oxazepine8-chlorodibenzo[b,f][1,4]oxazepineAKOS024404741AE-848/32722024
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