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2-(Thiophen-2-yl)pyrrolidine

HCID 339554
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
90090-64-5
Standard SMILES
c1csc(C2CCCN2)c1
InChIKey
BNUVOMNEUJWHCF-UHFFFAOYSA-N
Molecular formula
C8H11NS
Average molar mass
153.25 g/mol
Monoisotopic mass
153.06122053

Names & identifiers

Preferred name
2-(Thiophen-2-yl)pyrrolidine
IUPAC
2-thiophen-2-ylpyrrolidine
English name
2-(Thien-2-yl)pyrrolidine
Molecular formula
C8H11NS
Molecular weight
153.25

Names & synonyms

2-(thiophen-2-yl)pyrrolidine90090-64-5DTXSID00320932RefChem:254833DTXCID50272053677-273-32-(2-thienyl)pyrrolidine2-thiophen-2-ylpyrrolidine2-Thiophen-2-yl-pyrrolidineMFCD00052889pyrrolidine, 2-(2-thienyl)-2-(thien-2-yl)pyrrolidine
Show more names
AKOS BB-88692-THIEN-2-YLPYRROLIDINE3-(THIOPHEN-2-YL)PYRROLIDINE2-(thiophene-2-yl)pyrrolidineTIANFU-CHEM 90090-64-5 2-(Thien-2-yl)pyrrolidine
2-pyrrolidin-2-ylthiophene2-(Thiophen-2-yl)pyrrolidine;Oprea1_761182SCHEMBL166764SCHEMBL1607054(RS)-2-thien-2-yl-pyrrolidineDTXSID50902762BNUVOMNEUJWHCF-UHFFFAOYSA-N

Database identifiers

CAS
90090-64-5
PubChem CID
339554
DTXSID
DTXSID00320932
EC Number
677-273-3
Nikkaji
J767.989K

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
40.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
116

Physicochemical properties

Boiling point
88 · 88-89 °C(Press: 3 Torr)
Density
1.107 · 1.107±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.
2 · 2-8°C
solubility
DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
form
Oil
pka
9.947 · 9.947±0.10(predicted)
color
Clear Colourless
Water Solubility
Soluble in water.
Sensitive
Moisture Sensitive
CAS DataBase Reference
90090 · 90090-64-5(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes
C,Xi

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

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 5 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 (100%)

Safety data

hs_code
2933998090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
C,Xi
safety_code
26-36/37/39
hazard_class
IRRITANT
Hazard statements
H315-H319-H335
Precautionary statements
P261-P280a-P304+P340-P305+P351+P338-P405-P501a

Chemistry & industry

Applications

Uses2-(2-Thienyl)pyrrolidine is used in the preparation of imidazopyridine derivatives for treating viral infections.

Upstream & downstream products

Upstream raw materials

2-IodothiopheneTin4-ChlorobutyronitrileDiethyl etherHydrochloric acidMagnesium

Suppliers34 total

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]

Related reactions

8 records
New reaction record
HRID 562042 reaction equation
HRID 562042As reactantuspto-grants-2011_11
HRID 662316 reaction equation
HRID 662316As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1128909 reaction equation
HRID 1128909As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1548057 reaction equation
HRID 1548057As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1594721 reaction equation
HRID 1594721As reactantuspto-grants-2001_09
HRID 1594722 reaction equation
HRID 1594722As reactantuspto-grants-2001_09
HRID 1594723 reaction equation
HRID 1594723As reactantuspto-grants-2001_09
HRID 1806230 reaction equation
HRID 1806230As reactantuspto-grants-2013_01

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39
HazardClass
IRRITANT
HS Code
2933998090 · 2933998090
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
凯方医药科技(上海)有限公司021-67220633 021-54824098 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
上海再启生物技术有限公司021-54824098, 021-37212705 021-37212706, 13391256916 · [email protected]
河北博新生物科技有限公司19131160546 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
上海智乾生物科技有限公司[email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
上海有集材料有限公司13052376889 13681663468 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-15350571055 · [email protected]
郑州研德生物科技有限公司13298105281 · [email protected]