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Home > Aldehydes > 2060060-19-5
2060060-19-5 | 1-ethyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde
CAS No: 2060060-19-5 Catalog No: AG01BPAL MDL No:MFCD30500025
Product Description
Catalog Number:
AG01BPAL
Chemical Name:
1-ethyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde
CAS Number:
2060060-19-5
Molecular Formula:
C14H12F3NO
Molecular Weight:
267.2464
MDL Number:
MFCD30500025
IUPAC Name:
1-ethyl-3-[2-(trifluoromethyl)phenyl]pyrrole-2-carbaldehyde
InChI:
InChI=1S/C14H12F3NO/c1-2-18-8-7-11(13(18)9-19)10-5-3-4-6-12(10)14(15,16)17/h3-9H,2H2,1H3
InChI Key:
DDQNRAXUFFZZRG-UHFFFAOYSA-N
SMILES:
O=Cc1n(CC)ccc1c1ccccc1C(F)(F)F
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.087g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.251g/mol
Monoisotopic Mass:
267.087g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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