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1695985-96-6 | 4-(3-methoxypyrrolidin-1-yl)thiophene-2-carbaldehyde
CAS No: 1695985-96-6 Catalog No: AG01C8OK MDL No:MFCD31443186
Product Description
Catalog Number:
AG01C8OK
Chemical Name:
4-(3-methoxypyrrolidin-1-yl)thiophene-2-carbaldehyde
CAS Number:
1695985-96-6
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD31443186
IUPAC Name:
4-(3-methoxypyrrolidin-1-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C10H13NO2S/c1-13-9-2-3-11(5-9)8-4-10(6-12)14-7-8/h4,6-7,9H,2-3,5H2,1H3
InChI Key:
OJLNTHGCDUPUAD-UHFFFAOYSA-N
SMILES:
COC1CCN(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:
0
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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