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1566931-37-0

1566931-37-0 | 4-[3-(HYDROXYMETHYL)PYRROLIDIN-1-YL]THIOPHENE-2-CARBALDEHYDE

CAS No: 1566931-37-0 Catalog No: AG01C8OJ MDL No:MFCD26866561

Product Description

Catalog Number:
AG01C8OJ
Chemical Name:
4-[3-(HYDROXYMETHYL)PYRROLIDIN-1-YL]THIOPHENE-2-CARBALDEHYDE
CAS Number:
1566931-37-0
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD26866561
IUPAC Name:
4-[3-(hydroxymethyl)pyrrolidin-1-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H13NO2S/c12-5-8-1-2-11(4-8)9-3-10(6-13)14-7-9/h3,6-8,12H,1-2,4-5H2
InChI Key:
MAYOHJBJNYJSRZ-UHFFFAOYSA-N
SMILES:
OCC1CCN(C1)c1csc(c1)C=O

Properties

Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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