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4-Chloromethylthiazol-2-ylamine

HCID 73229
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
7250-84-2
Standard SMILES
Nc1nc(CCl)cs1
InChIKey
QYKUGBMFPFOPNE-UHFFFAOYSA-N
Molecular formula
C4H5ClN2S
Average molar mass
148.61 g/mol
Monoisotopic mass
147.98619684

Names & identifiers

Preferred name
4-Chloromethylthiazol-2-ylamine
IUPAC
4-(chloromethyl)-1,3-thiazol-2-amine
English name
4-(chloromethyl)-2-thiazolamine
Molecular formula
C4H5ClN2S
Molecular weight
148.61

Names & synonyms

4-chloromethylthiazol-2-ylamineRefChem:522004675-029-07250-84-24-(Chloromethyl)thiazol-2-amine4-(chloromethyl)-2-thiazolamine4-(chloromethyl)-1,3-thiazol-2-amine4-Chloromethyl-thiazol-2-ylamine2-amino-4-chloromethylthiazole2-amino-4-(chloromethyl)thiazole2-Thiazolamine, 4-(chloromethyl)-MFCD00616514
Show more names
2-Amino-4-chloromethylthiazole, CAS 7250-84-2
Thiazole, 2-amino-4-(chloromethyl)-4-(Chloromethyl)-1,3-thiazol-2-ylamineNSC568212-amino-4-chloromethyl thiazole4-(chloromethyl)-1,3-thiazole-2-ylamine2-amino-4-chloromethyl-1,3-thiazoleSCHEMBL77889SCHEMBL27015453

Database identifiers

CAS
7250-84-2
PubChem CID
73229
DTXSID
DTXSID30275724
EC Number
675-029-0
Nikkaji
J99.961J

Properties

Computed structural properties

XLogP
1
Topological polar surface area
67.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
8
Formal charge
0
Complexity
80.4

Physicochemical properties

storage temp.
2 · 2-8°C
Comptox DTXSID
30275724 · DTXSID30275724
Symbol(GHS)
6 · GHS06,GHS08,GHS09
Signal word
Danger
Hazard statements
301 · H301+H331-H360-H373-H350-H410
Precautionary statements
501 · P501-P273-P260-P270-P202-P201-P271-P264-P280-P391-P308+P313-P301+P310+P330-P304+P340+P311-P403+P233-P405
HS Code
2934100090 · 2934100090

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Danger

H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

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

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (50%)

Safety data

hs_code
2934100090
Signal word
Danger
Symbol(GHS)
GHS06,GHS08,GHS09
Hazard statements
H301+H331-H360-H373-H350-H410
Precautionary statements
P501-P273-P260-P270-P202-P201-P271-P264-P280-P391-P308+P313-P301+P310+P330-P304+P340+P311-P403+P233-P405

Chemistry & industry

Upstream & downstream products

Upstream raw materials

EthanolEthyl bromopyruvateDiethyl etherLithium Aluminum HydrideOxalyl chlorideThiourea

Related reactions

48 records
New reaction record
HRID 20496 reaction equation
HRID 20496As reactantuspto-grants-2010_06
HRID 109668 reaction equation
HRID 109668As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 131863 reaction equation
HRID 131863As reactantuspto-grants-2008_06
HRID 131898 reaction equation
HRID 131898As reactantuspto-grants-2008_06
HRID 142380 reaction equation
HRID 142380As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 145968 reaction equation
HRID 145968As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 153633 reaction equation
HRID 153633As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 181741 reaction equation
HRID 181741As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
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Compound notes

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