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1-(5-bromo-1,2-thiazol-3-yl)methanamine hydrochloride

1-(5-bromo-1,2-thiazol-3-yl)methanamine hydrochloride

CAS: 2493200-78-3

Formula: C4H6BrClN2S

SMILES: Cl.NCC1=NSC(Br)=C1

IUPAC: 1-(5-bromo-1,2-thiazol-3-yl)methanamine hydrochloride

InChI: InChI=1S/C4H5BrN2S.ClH/c5-4-1-3(2-6)7-8-4;/h1H,2,6H2;1H

Composition: C (20.93%), H (2.64%), Br (34.81%), Cl (15.45%), N (12.21%), S (13.97%)

Molar Mass: 229.52

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 227.91236
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CRARAUUNLWZDHN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.73
Topological Polar Surface Area 38.91
Polarizability 14.53
Ring Count 1
Rotatable Bond Count 1

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96% <2 Days 2493200-78-3 $243.80-$7,912.00$243.80$373.75$631.35$1,147.70$2,047.00$7,912.00
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