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Ethyl 2-carbamimidamido-4-methyl-1,3-thiazole-5-carboxylate hydrochloride

HCID 18322720
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Basic information

CAS
131184-96-8
Standard SMILES
CCOC(=O)c1sc(N=C(N)N)nc1C.Cl
InChIKey
IIZWYNDWOXSKNC-UHFFFAOYSA-N
Molecular formula
C8H13ClN4O2S
Average molar mass
264.73 g/mol
Monoisotopic mass
264.0447745

Names & identifiers

Preferred name
Ethyl 2-carbamimidamido-4-methyl-1,3-thiazole-5-carboxylate hydrochloride
IUPAC
ethyl 2-(diaminomethylideneamino)-4-methyl-1,3-thiazole-5-carboxylate;hydrochloride
English name
Ethyl 2-carbamimidamido-4-methyl-1,3-thiazole-5-carboxylate hydrochloride
Molecular formula
C8H13ClN4O2S
Molecular weight
265

Names & synonyms

131184-96-8ethyl 2-carbamimidamido-4-methyl-1,3-thiazole-5-carboxylate hydrochlorideMFCD18651776Ethyl 2-guanidino-4-methylthiazole-5-carboxylate hydrochlorideethyl 2-(diaminomethylideneamino)-4-methyl-1,3-thiazole-5-carboxylate;hydrochlorideIIZWYNDWOXSKNC-UHFFFAOYSA-NSCHEMBL7147143DTXSID70592785AKOS008098530AKOS015849817BF-0729CS-0313075
Show more names
MFCD081317772-guanidino-4-methyl-5-thiazolecarboxylic acid ethyl ester2-guanidino-4-methyl-thiazole-5-carboxylic acid ethyl esterethyl 2-(diaminomethylideneamino)-4-methyl-1,3-thiazole-5-carboxylateethyl 2-{[amino(imino)methyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Z1263708120ethyl 2-guanidino-4-methyl-thiazole-5-carboxylate hydrochlorideethyl 2-guanidino-4-methyl-thiazole-5-carboxylate;hydrochlorideethyl2-carbamimidamido-4-methyl-1,3-thiazole-5-carboxylatehydrochloride5-Thiazolecarboxylic acid, 2-[(aminoiminomethyl)amino]-4-methyl-, ethyl ester, hydrochloride (1:1)Ethyl 2-[(diaminomethylidene)amino]-4-methyl-1,3-thiazole-5-carboxylate--hydrogen chloride (1/1)

Database identifiers

CAS
131184-96-8
PubChem CID
18322720
DTXSID
DTXSID70592785

Properties

Computed structural properties

Topological polar surface area
132 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
267

Physicochemical properties

HazardClass
IRRITANT

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hazard_class
IRRITANT

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Compound notes

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