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1550801-84-7 | 5-CHLORO-1-ETHYL-2-METHYL-1H-INDOLE-3-CARBALDEHYDE
CAS No: 1550801-84-7 Catalog No: AG01BSHG MDL No:MFCD26733146
Product Description
Catalog Number:
AG01BSHG
Chemical Name:
5-CHLORO-1-ETHYL-2-METHYL-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
1550801-84-7
Molecular Formula:
C12H12ClNO
Molecular Weight:
221.6828
MDL Number:
MFCD26733146
IUPAC Name:
5-chloro-1-ethyl-2-methylindole-3-carbaldehyde
InChI:
InChI=1S/C12H12ClNO/c1-3-14-8(2)11(7-15)10-6-9(13)4-5-12(10)14/h4-7H,3H2,1-2H3
InChI Key:
ANNACLRATJKKHZ-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)n(c2c1cc(Cl)cc2)CC
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.061g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.684g/mol
Monoisotopic Mass:
221.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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