Basic information
- CAS
45438-77-5- Standard SMILES
ClCc1cncs1- InChIKey
UZAOOCPKYMGRHG-UHFFFAOYSA-N- Molecular formula
- C4H4ClNS
- Average molar mass
- 133.6 g/mol
- Monoisotopic mass
- 132.97529781
Names & identifiers
- Preferred name
- 5-(Chloromethyl)thiazole
- IUPAC
- 5-(chloromethyl)-1,3-thiazole
- English name
- 5-Chloromethylthiazole
- Molecular formula
- C4H4ClNS
- Molecular weight
- 133.6
Names & synonyms
5-(chloromethyl)thiazole45438-77-5DTXSID50276839RefChem:300376DTXCID502280355-(chloromethyl)-1,3-thiazole5-CHLOROMETHYLTHIAZOLEMFCD118701305-Chloromethyl-thiazoleThiazole, 5-(chloromethyl)-, hydrochlorideThiazole, 5-(chloromethyl)-5-(Chloromethyl);thiazole
Show more names
5-thiazolylmethyl chloride5-(chloromethyl)-1,3-thiazole hydrochloride
SCHEMBL507903SCHEMBL3047530SCHEMBL16113799UZAOOCPKYMGRHG-UHFFFAOYSA-NALBB-026996AKOS006382380AB64977DB-358642
Database identifiers
- CAS
45438-77-5- PubChem CID
- 205481
- DTXSID
DTXSID50276839
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 59.7
Physicochemical properties
- form
- solid
- InChI
- 1S/C4H4ClNS.ClH/c5-1-4-2-6-3-7-4;/h2-3H,1H2;1H
- InChIKey
- ZIESYFUVRJDNNW-UHFFFAOYSA-N
- SMILES
- ClCC1=CN=CS1.Cl
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- WGK Germany
- 3 · WGK 3
- Storage Class
- 11 · 11 - Combustible Solids
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
- wgk
- WGK 3
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Suppliers32 total
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
上海爱孜康医药研究有限公司18721109360 · [email protected]
廊坊凯美科思生物科技有限公司15901279280; 15901279280 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河北贝克曼生物科技有限公司15961617865 15961617865 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
上海纳谦化学科技有限公司13598610367 0373-7129549 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
赛纳斯特化学（欢迎点击联系）021-60343070
上海彰锐化工科技有限公司021-54880687
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
Related reactions
4 records
Compound notes
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