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89725-81-5 | 1H-Indole-1-carboxaldehyde, 3-ethyl-, oxime
CAS No: 89725-81-5 Catalog No: AG00429E MDL No:
Product Description
Catalog Number:
AG00429E
Chemical Name:
1H-Indole-1-carboxaldehyde, 3-ethyl-, oxime
CAS Number:
89725-81-5
Molecular Formula:
C11H12N2O
Molecular Weight:
188.2258
IUPAC Name:
N-[(3-ethylindol-1-yl)methylidene]hydroxylamine
InChI:
InChI=1S/C11H12N2O/c1-2-9-7-13(8-12-14)11-6-4-3-5-10(9)11/h3-8,14H,2H2,1H3
InChI Key:
VECWBNQJAYZNEL-UHFFFAOYSA-N
SMILES:
ON=Cn1cc(c2c1cccc2)CC
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.23g/mol
Monoisotopic Mass:
188.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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