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92297-75-1 | 1-chloro-3-(1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene)propan-2-one
CAS No: 92297-75-1 Catalog No: AG019GXP MDL No:MFCD02692138
Product Description
Catalog Number:
AG019GXP
Chemical Name:
1-chloro-3-(1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene)propan-2-one
CAS Number:
92297-75-1
Molecular Formula:
C14H16ClNO
Molecular Weight:
249.7359
MDL Number:
MFCD02692138
IUPAC Name:
1-chloro-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one
InChI:
InChI=1S/C14H16ClNO/c1-14(2)11-6-4-5-7-12(11)16(3)13(14)8-10(17)9-15/h4-8H,9H2,1-3H3
InChI Key:
BRXMHAHJRYVVSM-UHFFFAOYSA-N
SMILES:
ClCC(=O)C=C1N(C)c2c(C1(C)C)cccc2
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.092g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.738g/mol
Monoisotopic Mass:
249.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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