C1=CC2=C(C(=C1)Br)N=CC=C2
CAS: 16567-18-3
名称: 8-bromoquinoline
SMILES: C1=CC2=C(C(=C1)Br)N=CC=C2

Molecular Processing

Molecular formula
C9H6BrN
Molecular weight
208.06
Exact mass
206.9684
XLogP
3
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
49.44

Supplementary Information

InChIKey: PIWNKSHCLTZKSZ-UHFFFAOYSA-N
同義語
8-BromoquinolineRefChem:547864630-629-116567-18-3Quinoline, 8-bromo-8-Bromo-quinolineMFCD001918598-Bromoquinoline #8-Bromoquinoline, 98%SCHEMBL196509SCHEMBL1926970SCHEMBL6312154SCHEMBL10476670SCHEMBL27167448SCHEMBL29022899DTXSID10168009SBB054586AKOS001476139AB04626AC-1231CS-W002501FS-2279SY014149DB-007220ST50307494EN300-55898F040578Z839152792
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