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144586-89-0 | 1H-Pyrrole-2-carboxaldehyde,3,4-diethyl-5-ethynyl-(9CI)
CAS No: 144586-89-0 Catalog No: AG00B2U3 MDL No:
Product Description
Catalog Number:
AG00B2U3
Chemical Name:
1H-Pyrrole-2-carboxaldehyde,3,4-diethyl-5-ethynyl-(9CI)
CAS Number:
144586-89-0
IUPAC Name:
3,4-diethyl-5-ethynyl-1H-pyrrole-2-carbaldehyde
InChI:
InChI=1S/C11H13NO/c1-4-8-9(5-2)11(7-13)12-10(8)6-3/h3,7,12H,4-5H2,1-2H3
InChI Key:
HWBGAPLQMVFXEI-UHFFFAOYSA-N
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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