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7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline

7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline

CAS: 848185-12-6

Formula: C10H12BrN

SMILES: CC1CC2=CC=C(Br)C=C2CN1

IUPAC: 7-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline

InChI: InChI=1/C10H12BrN/c1-7-4-8-2-3-10(11)5-9(8)6-12-7/h2-3,5,7,12H,4,6H2,1H3

Composition: C (53.12%), H (5.35%), Br (35.34%), N (6.19%)

Molar Mass: 226.117

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 225.015312
Formal Charge 0
FSP3 0.4
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ROFNCPGXJWHJIZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.66
Topological Polar Surface Area 12.03
Polarizability 21.12
Ring Count 2
Rotatable Bond Count 0

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96% <2 Days 848185-12-6 $165.60-$3,447.70$165.60$216.20$316.25$516.35$917.70$3,447.70
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