Mbth Hcl

CAT: 1299-RG-M281211-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-M281211-02Size:25 mg

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CAS Number

38894-11-0

Synonyms

2-hydrazineylidene-3-methyl-2,3-dihydrobenzo[d]thiazole hydrochloride

Molecular Formula

C8H10ClN3S

Molecular Weight

215.7

Target Alternative Name

Mbth

Product Name Synonym

2-hydrazineylidene-3-methyl-2,3-dihydrobenzo[d]thiazole hydrochloride

Chemical Information

3-Methyl-2-benzothiazolinone hydrazone hydrochloride monohydrate

CAS Number	38894-11-0
PubChem CID	6364530
IUPAC Name	(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)hydrazine;hydrate;hydrochloride
Molecular Formula	C8H12ClN3OS
Molecular Weight	233.72
Topological Polar Surface Area	67.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	14
Formal Charge	0
Complexity	204

SMILES

CN\1C2=CC=CC=C2S/C1=N\N.O.Cl

InChI

InChI=1S/C8H9N3S.ClH.H2O/c1-11-6-4-2-3-5-7(6)12-8(11)10-9;;/h2-5H,9H2,1H3;1H;1H2/b10-8-;;

InChIKey

IYXXQOGEFHAQGU-GPWRMYTLSA-N

Chemical Structure

2D Structure

CAS: 38894-11-0

CID: 6364530

Formula: C8H12ClN3OS

MW: 233.72

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.72
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	233.0389609
Monoisotopic Mass	233.0389609
Topological Polar Surface Area	67.9 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	204
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

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