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6-bromo-1,2,3,4-tetrahydroquinolin-3-ol

6-bromo-1,2,3,4-tetrahydroquinolin-3-ol

CAS: 1520404-59-4

Formula: C9H10BrNO

SMILES: OC1CNC2=CC=C(Br)C=C2C1

IUPAC: 6-bromo-1,2,3,4-tetrahydroquinolin-3-ol

InChI: InChI=1/C9H10BrNO/c10-7-1-2-9-6(3-7)4-8(12)5-11-9/h1-3,8,11-12H,4-5H2

Composition: C (47.39%), H (4.42%), Br (35.03%), N (6.14%), O (7.01%)

Molar Mass: 228.089

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 226.994577
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey DCQSFUBAGRYUJR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.15
Topological Polar Surface Area 32.26
Polarizability 19.63
Ring Count 2
Rotatable Bond Count 0

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97% <5 Days 1520404-59-4 $307.68-$475.40$307.68$475.40
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