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23114-47-8 | 1H-Indene-2-carboxamide, 3-(3-chloropropyl)-1-oxo-
CAS No: 23114-47-8 Catalog No: AG002M7T MDL No:
Product Description
Catalog Number:
AG002M7T
Chemical Name:
1H-Indene-2-carboxamide, 3-(3-chloropropyl)-1-oxo-
CAS Number:
23114-47-8
Molecular Formula:
C13H12ClNO2
Molecular Weight:
249.6929
IUPAC Name:
1-(3-chloropropyl)-3-oxoindene-2-carboxamide
InChI:
InChI=1S/C13H12ClNO2/c14-7-3-6-9-8-4-1-2-5-10(8)12(16)11(9)13(15)17/h1-2,4-5H,3,6-7H2,(H2,15,17)
InChI Key:
WNZYGVKLVNBEAW-UHFFFAOYSA-N
SMILES:
ClCCCC1=C(C(=O)N)C(=O)c2c1cccc2
NSC Number:
140890
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.694g/mol
Monoisotopic Mass:
249.056g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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