Basic information
- CAS
101993-01-5- Standard SMILES
NC1CCSC1- InChIKey
GBNRIMMKLMTDLW-UHFFFAOYSA-N- Molecular formula
- C4H9NS
- Average molar mass
- 103.19 g/mol
- Monoisotopic mass
- 103.04557029
Names & identifiers
- Preferred name
- Thiolan-3-amine
- IUPAC
- thiolan-3-amine
- English name
- 3-THIOPHENAMINE, TETRAHYDRO-
- Molecular formula
- C4H9NS
- Molecular weight
- 103.19
Names & synonyms
Thiolan-3-amine101993-01-5DTXSID30335110RefChem:897823DTXCID90286199841-229-3Tetrahydrothiophen-3-amineTETRAHYDROTHIEN-3-YLAMINE3-Thiophenamine, tetrahydro-tetrahydro-3-thienylamineMFCD00120988C4H9NS
Show more names
3-ThiacyclopentylaMinTetrahydro-3-thiophenaMine3-Thiophenamine,tetrahydro-(9CI)tetrahydro-3-thienylamine(SALTDATA: FREE)3-THIOPHENAMINE, TETRAHYDRO- ISO 9001：2015 REACH
3-aminotetrahydrothiophene3-aminotetrahydrothio-phenetetrahydrothiophene-3-aminetetrahydrothiophen-3-ylamineSCHEMBL962080SCHEMBL3149523SCHEMBL7565467GBNRIMMKLMTDLW-UHFFFAOYSA-N
Database identifiers
- CAS
101993-01-5- PubChem CID
- 522918
- DTXSID
DTXSID30335110- EC Number
- 841-229-3
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 46.8
Physicochemical properties
- Boiling point
- 75 · 75-78 °C(Press: 16 Torr)
- Density
- 1.077 · 1.077±0.06 g/cm3(Predicted)
- pka
- 8.9 · 8.90±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 227 · H227-H302-H315-H335-H318
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
- Hazard Codes
- Xi,Xn
- Risk Statements
- 22 · 22-36
- Safety Statements
- 26 · 26
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Danger
H226 (33.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 4 (66.7%)
Safety data
- risk_code
- 22-36
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- hazard_code
- Xi,Xn
- safety_code
- 26
- hazard_class
- IRRITANT
- Hazard statements
- H227-H302-H315-H335-H318
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P210-P280-P370+P378-P403+P235-P501-P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers17 total
Syntechem Co.,Ltd[email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
杭州扬德医药科技有限公司0571-81953185 +86-15381198709 · [email protected]
上海飞琰化工科技有限公司021-34663897 13816465839 · [email protected]
上海宣月科技有限公司15216675652 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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