2-Amidinothiophene hydrochloride

C₅H₇ClN₂SCAS 54610-70-7162.64 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₇ClN₂S
Molar mass: 162.64 g/mol
Exact mass: 162.0018 Da
logP: 1.45Crippen estimate
Polar surface area: 49.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled20% of notifiers
H302 Harmful if swallowed60% of notifiers
H312 Harmful in contact with skin20% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled20% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 5 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

54610-70-7

SMILES

C1=CSC(=C1)C(=N)N.Cl

InChIKey

URAGJMBGNVOIJC-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2S.ClH/c6-5(7)4-2-1-3-8-4;/h1-3H,(H3,6,7);1H

Weigh it out

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

Names and synonyms

1 names

Thiophene-2-carboximidamide Hydrochloride

Work with 2-Amidinothiophene 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

Similar compounds

Benzamidine hydrochloride1670-14-048 % similar 2-Thiophenecarbothioamide20300-02-147 % similar 2-Thiophenecarboxamide5813-89-847 % similar 1,3-Thiazole-2-carboximidamide hydrochloride247037-82-746 % similar Benzenecarboximidamide, hydrochloride, hydrate (1:1:?)206752-36-544 % similar Biphenyl-4-carboxamidine hydrochloride111082-23-643 % similar 2-Thienyl ketone704-38-142 % similar 2,2'-Thenil7333-07-542 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Mercapto-4-methylpyrimidine hydrochloride6959-66-6

Elsewhere

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