Basic information
- CAS
40197-02-2- Standard SMILES
Cc1cc(I)c(C)s1- InChIKey
SHOXGOWAOZUVEB-UHFFFAOYSA-N- Molecular formula
- C6H7IS
- Average molar mass
- 238.09 g/mol
- Monoisotopic mass
- 237.93132
Names & identifiers
- Preferred name
- 3-Iodo-2,5-dimethylthiophene
- IUPAC
- 3-iodo-2,5-dimethylthiophene
- English name
- 3-iodo-2,5-diMethylthiophene
- Molecular formula
- C6H7IS
- Molecular weight
- 238.09
Names & synonyms
3-iodo-2,5-dimethylthiopheneDTXSID60305462RefChem:502668DTXCID70256592853-989-340197-02-2MFCD223697983-iodo-2,5-dimethyl-thiopheneC6H7ISNSC1708273-iodo-25-diMethylthiopheneSCHEMBL5389823
Show more names
Thiophene, 3-iodo-2,5-dimethyl-QBA19702CS2241AKOS024462470NSC-170827AS-82062SY075502DB-294365
Database identifiers
- CAS
40197-02-2- PubChem CID
- 298613
- DTXSID
DTXSID60305462- EC Number
- 853-989-3
- Nikkaji
- J3.114.204K
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 84.6
Physicochemical properties
- Boiling point
- 99 · 99-101 °C(Press: 10 Torr)
- Density
- 1.782 · 1.782±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- Yellow to brown Liquid
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335-H302-H332
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
- HS Code
- 29349990 · 29349990
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 29349990
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H315-H318-H335-H302-H332
- Precautionary statements
- P280-P305+P351+P338-P310-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers41 total
河南萨克斯生物科技有限公司13803717460 · [email protected]
上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
南京翔睿科技有限公司021-021-00000000 15715199582 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
山东中图化工有限公司17864755731 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
安徽合诺生物科技有限公司18455579438
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
Shanxi Tihondan Pharmaceutical Technology Co., Ltd+8618235132063 · [email protected]
Shanghai Scibiotron Pharmaceutical Co., Ltd+86-16621589600 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
广州康瑞泰药业有限公司020-82185713,82185709 13418171485 · [email protected]
台州市易康化工有限公司0576-88501337 18057652630 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
碧语生物科技（上海）有限公司021-26018599
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
山东宜仁药业有限公司531-87922518 15628888630 · [email protected]
河南氢硅新材料科技有限公司00-18037331-859 18037331859 · [email protected]
江西伯业医药科技有限公司027-18971341812/18971341812 18971341812 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
郑州艾克姆化工有限公司0371-63315541 13323832564 · [email protected]
河南阿尔法化工有限公司0371-55055611 18137792234 · [email protected]
武汉爱默尔特科技有限公司027-888-4366503 13986279625 · [email protected]
沈阳莫德医药科技有限公司024-23982345 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
SHANGHAI YOUNG-CHEM CHEMICAL CO., LTD.13817489192 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
河南赢创生物科技有限公司16650708709 · [email protected]
江西伯业医药科技有限公司15387090420 15387090420 · [email protected]
杭州海蓝化工有限公司+86-57156122185 +86-15967590394 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京健傲医药科技有限公司18915922978 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
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Compound notes
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