Text Search
Structure Search

6-bromo-3,4-dihydro-2H-1-benzothiopyran-4-amine hydrochloride

6-bromo-3,4-dihydro-2H-1-benzothiopyran-4-amine hydrochloride

CAS: 1170470-60-6

Formula: C9H11BrClNS

SMILES: Cl.NC1CCSC2=C1C=C(Br)C=C2

IUPAC: 6-bromo-3,4-dihydro-2H-1-benzothiopyran-4-amine hydrochloride

InChI: InChI=1/C9H10BrNS.ClH/c10-6-1-2-9-7(5-6)8(11)3-4-12-9;/h1-2,5,8H,3-4,11H2;1H

Composition: C (38.52%), H (3.95%), Br (28.48%), Cl (12.63%), N (4.99%), S (11.43%)

Molar Mass: 280.61

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 278.948411
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PHXMSFQOCYPAGT-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.53
Topological Polar Surface Area 26.02
Polarizability 22.42
Ring Count 2
Rotatable Bond Count 0

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
LabNetwork INC
Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 1170470-60-6 $448.20$448.20
Request Quote