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Home > Indoles and Oxindole > 1391740-34-3
1391740-34-3 | 5-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE
CAS No: 1391740-34-3 Catalog No: AG01BNHR MDL No:MFCD22682154
Product Description
Catalog Number:
AG01BNHR
Chemical Name:
5-PROPYL-2,3-DIHYDRO-1H-ISOINDOLE
CAS Number:
1391740-34-3
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD22682154
IUPAC Name:
5-propyl-2,3-dihydro-1H-isoindole
InChI:
InChI=1S/C11H15N/c1-2-3-9-4-5-10-7-12-8-11(10)6-9/h4-6,12H,2-3,7-8H2,1H3
InChI Key:
AAWXIKFUIAUMBJ-UHFFFAOYSA-N
SMILES:
CCCc1ccc2c(c1)CNC2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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