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2137530-76-6 | 1-ethyl-2,3-dihydro-1H-isoindole hydrochloride
CAS No: 2137530-76-6 Catalog No: AG01EJ4C MDL No:MFCD31457011
Product Description
Catalog Number:
AG01EJ4C
Chemical Name:
1-ethyl-2,3-dihydro-1H-isoindole hydrochloride
CAS Number:
2137530-76-6
Molecular Formula:
C10H14ClN
Molecular Weight:
183.6779
MDL Number:
MFCD31457011
IUPAC Name:
1-ethyl-2,3-dihydro-1H-isoindole;hydrochloride
InChI:
InChI=1S/C10H13N.ClH/c1-2-10-9-6-4-3-5-8(9)7-11-10;/h3-6,10-11H,2,7H2,1H3;1H
InChI Key:
NBMSODZCXWQFTA-UHFFFAOYSA-N
SMILES:
CCC1NCc2c1cccc2.Cl
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.081g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.679g/mol
Monoisotopic Mass:
183.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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