5-(4-Hydroxypiperidin-1-yl)thiophene-2-carboxaldehyde

HCID 2763540
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Substructure searchFind similar structures

Basic information

CAS
207290-72-0
Standard SMILES
O=Cc1ccc(N2CCC(O)CC2)s1
InChIKey
QGNLQHONMNFZJP-UHFFFAOYSA-N
Molecular formula
C10H13NO2S
Average molar mass
211.28 g/mol
Monoisotopic mass
211.06669966

Names & identifiers

Preferred name
5-(4-Hydroxypiperidin-1-yl)thiophene-2-carboxaldehyde
IUPAC
5-(4-hydroxypiperidin-1-yl)thiophene-2-carbaldehyde
English name
5-(4-Hydroxypiperidino)-2-thiophenecarbaldehyde
Molecular formula
C10H13NO2S
Molecular weight
211.28

Names & synonyms

5-(4-HYDROXYPIPERIDIN-1-YL)THIOPHENE-2-CARBOXALDEHYDERefChem:530407811-087-7207290-72-05-(4-hydroxypiperidin-1-yl)thiophene-2-carbaldehyde5-(4-hydroxypiperidino)-2-thiophenecarbaldehydeMFCD034257282-Thiophenecarboxaldehyde, 5-(4-hydroxy-1-piperidinyl)-5-(4-hydroxypiperidino)-2-thiophenecarboxaldehydeOprea1_5389985-(4-hydroxy-1-piperidyl)thiophene-2-carbaldehydeSCHEMBL1663548
Show more names
5-(4-Hydroxypiperidino)-2-Thio5-(4-Hydroxypiperidino)thiophene-2-carboxaldehyde5-(4-Hydroxy-1-piperidinyl)-2-thiophenecarboxaldehyde2-Formyl-5-(4-hydroxypiperidin-1-yl)thiophene, 1-(5-Formylthien-2-yl)-4-hydroxypiperidine
5-(4-hydroxypiperidin-1-yl)-thiophene-2-carboxaldehydeDTXSID20377004QGNLQHONMNFZJP-UHFFFAOYSA-NCL1304SBB066373AKOS002666062AC-3561SB43400

Database identifiers

CAS
207290-72-0
PubChem CID
2763540
DTXSID
DTXSID20377004
EC Number
811-087-7
Nikkaji
J948.319E

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
68.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
14

Physicochemical properties

Melting point
137 · 137-139°
Boiling point
417.8 · 417.8±45.0 °C(Predicted)
Density
1.321 · 1.321±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
form
powder to crystal
pka
14.77 · 14.77±0.20(Predicted)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (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 CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code
2934999090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302+H312+H332-H315-H319
Precautionary statements
P261-P264b-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362+P364-P403-P501c

Chemistry & industry

Upstream & downstream products

Suppliers51 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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