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Home > Indoles and Oxindole > 153254-28-5
153254-28-5 | 2-Allyl-2,3-dihydro-1H-indole
CAS No: 153254-28-5 Catalog No: AG01F6QI MDL No:
Product Description
Catalog Number:
AG01F6QI
Chemical Name:
2-Allyl-2,3-dihydro-1H-indole
CAS Number:
153254-28-5
Molecular Formula:
C11H13N
Molecular Weight:
159.2276
IUPAC Name:
2-prop-2-enyl-2,3-dihydro-1H-indole
InChI:
InChI=1S/C11H13N/c1-2-5-10-8-9-6-3-4-7-11(9)12-10/h2-4,6-7,10,12H,1,5,8H2
InChI Key:
TXWAXSBICZIIDB-UHFFFAOYSA-N
SMILES:
C=CCC1Cc2c(N1)cccc2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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