3-Methyl-2-benzothiazolinone hydrazone hydrochloride

HCID 78041CAS 14448-67-0
Substructure searchFind similar structures

Basic information

Standard SMILES
Cl.Cn1c(=NN)sc2ccccc21
InChIKey
OEZPVSPULCMUQB-UHFFFAOYSA-N
Molecular formula
C8H9N3S.ClH
Average molar mass
215.7 g/mol
Monoisotopic mass
215.028396

Names & identifiers

Preferred name
3-Methyl-2-benzothiazolinone hydrazone hydrochloride
IUPAC
(3-methyl-1,3-benzothiazol-2-ylidene)hydrazine;hydrochloride
English name
3-METHYL-2-BENZOTHIAZOLINONE HYDRAZONE HYDROCHLORIDE
Molecular formula
C8H10ClN3S
Molecular weight
215.7

Names & synonyms

3-Methyl-2-benzothiazolinone hydrazone hydrochloride4338-98-1149022-15-12(3H)-Benzothiazolone, 3-methyl-, hydrazone, monohydrochlorideRefChem:94726677-687-414448-67-03-Methyl-2-benzothiazolinonehydrazone Hydrochloride3-methyl-2-benzothiazolinoneHydrazone Hydrochloride HydrateDTXSID60884060(3-methyl-1,3-benzothiazol-2-ylidene)hydrazine;hydrochlorideM0160
Show more names
MBTH HCLBesthorn’shydrazonehydrochloride3-Methyl-2-benzothiazolinone hydrazone HCI3-Methylbenzothiazol-2(3H)-onehydrazoneHCl3-Methyl-2-BenzothiazolinoneHydrazoneHcl(Mbth)3-METHYLBENZOTHIAZOL-2-ONE HYDRAZONE HYDROCHLORIDE3-Methyl-2(3H)-benzothiazolonehydrazonehydrochloride2-Benzothiazolinone,3-methyl-,hydrazone,hydrochloride2(3H)-Benzothiazolone,3-methyl-,hydrazone,hydrochloride
3-methyl-1,3-benzothiazol-2-one hydrazone;hydrochloride2(3H)-Benzothiazolone, 3-methyl-, hydrazone, hydrochloride (1:1); 2(3H)-Benzothiazolone, 3-methyl-, hydrazone, monohydrochloride (9CI); 2-Benzothiazolinone, 3-methyl-, hydrazone, monohydrochloride (8CI); 2-Hydrazinylidene-3-methyl-2,3-dihydro-1,3-benzothi3-Methyl-2-benzothiazolinone hydrazone HClSCHEMBL691148(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)hydrazine;hydrochlorideSCHEMBL30738267EAA33898AKOS028108517

Database identifiers

CAS
14448-67-0、149022-15-1、4338-98-1
PubChem CID
78041
DTXSID
DTXSID60884060
EC Number
224-393-5、238-428-7、677-687-4

Properties

Computed structural properties

Topological polar surface area
66.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
13

Physicochemical properties

Melting point
270 ℃ · approximate 270℃(decomposition)
form
Liquid
color
Clear colorless
FDA UNII
9 U2C4W7EPR · 9U2C4W7EPR
Symbol(GHS)
6 · GHS06
Signal word
Danger

Safety & regulation

GHS classification

GHS Classification · 6 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

Hazard information

Regulatory Information · 2 items

Chemical: 2(3H)-Benzothiazolone, 3-methyl-, hydrazone, hydrochloride (1:1)

3-Methyl-2-benzothiazolinone hydrazone hydrochloride: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and Categories · 3 items

Acute Tox. 3 (100%)

Acute Tox. 3 (100%)

Acute Tox. 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301-H319
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2(3H)-Benzothiazolone, 3-methyl-, hydrazone, hydrochloride (1:1): ACTIVE

Applications

UsesUsed as an intermediate for dyes.

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]

Related reactions

6 records
New reaction record

Linked notes

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