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2060027-14-5 | 1-ethyl-3-(thiophen-2-yl)-1H-pyrrole-2-carbaldehyde
CAS No: 2060027-14-5 Catalog No: AG01BPAZ MDL No:MFCD30500039
Product Description
Catalog Number:
AG01BPAZ
Chemical Name:
1-ethyl-3-(thiophen-2-yl)-1H-pyrrole-2-carbaldehyde
CAS Number:
2060027-14-5
Molecular Formula:
C11H11NOS
Molecular Weight:
205.2761
MDL Number:
MFCD30500039
IUPAC Name:
1-ethyl-3-thiophen-2-ylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C11H11NOS/c1-2-12-6-5-9(10(12)8-13)11-4-3-7-14-11/h3-8H,2H2,1H3
InChI Key:
HFHLZEGQABQECN-UHFFFAOYSA-N
SMILES:
O=Cc1n(CC)ccc1c1cccs1
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.275g/mol
Monoisotopic Mass:
205.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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