4,5,6,7-Tetrahydrothieno[3,2-c]pyridine hydrochloride

C7H10ClNSCAS 28783-41-7175.67 g/mol

Open in Covalent MOL file
HClSNH
Secondary amine

Properties

Molecular formula
C7H10ClNS
Molar mass
175.67 g/mol
Exact mass
175.0222 Da
Melting point
220–230 °C
logP
1.82Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
28783-41-7
SMILES
Cl.c1cc2c(s1)CCNC2
InChIKey
QMXCTKPNQFJZGK-UHFFFAOYSA-N
InChI
InChI=1S/C7H9NS.ClH/c1-3-8-5-6-2-4-9-7(1)6;/h2,4,8H,1,3,5H2;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Thieno[3,2-C]pyridine, 4,5,6,7-tetrahydro-, hydrochloride (1:1)
  • Thieno[3,2-c]pyridine, 4,5,6,7-tetrahydro-, hydrochloride
  • 4,5,6,7-Tetrahydrothieno(3,2-c)pyridinium chloride

Work with 4,5,6,7-Tetrahydrothieno[3,2-c]pyridine hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

4,5,6,7-Tetrahydrothieno[3,2-c]pyridine54903-50-3Free base

Similar compounds

1,2,3,4-Tetrahydroisoquinoline hydrochloride14099-81-150 % similar 6-Bromo-1,2,3,4-tetrahydroisoquinoline hydrochloride215798-19-942 % similar 7-Bromo-1,2,3,4-tetrahydroisoquinoline hydrochloride220247-73-442 % similar Tetrahydroisoquinoline91-21-441 % similar 2-Chloro-5,6,7,8-tetrahydro-1,6-naphthyridine hydrochloride766545-20-440 % similar 6,7-Dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride2328-12-339 % similar 7-Trifluoromethyl-1,2,3,4-tetrahydro-isoquinoline hydrochloride220247-87-039 % similar 6-Methoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride57196-62-039 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Chloromethyl-2-isopropyl-thiazole40516-57-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook