Home Aminos 3-(aminomethyl)-2-benzyl-2,3-dihydro-1H-isoindol-1-one hydrochloride

3-(aminomethyl)-2-benzyl-2,3-dihydro-1H-isoindol-1-one hydrochloride

CAS No.:
2044713-29-1
Catalog Number:
AG01BUPY
Molecular Formula:
C16H17ClN2O
Molecular Weight:
288.7720
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Product Description
Catalog Number:
AG01BUPY
Chemical Name:
3-(aminomethyl)-2-benzyl-2,3-dihydro-1H-isoindol-1-one hydrochloride
CAS Number:
2044713-29-1
Molecular Formula:
C16H17ClN2O
Molecular Weight:
288.7720
MDL Number:
MFCD30476172
IUPAC Name:
3-(aminomethyl)-2-benzyl-3H-isoindol-1-one;hydrochloride
InChI:
InChI=1S/C16H16N2O.ClH/c17-10-15-13-8-4-5-9-14(13)16(19)18(15)11-12-6-2-1-3-7-12;/h1-9,15H,10-11,17H2;1H
InChI Key:
JIHKVWTZSNVAFJ-UHFFFAOYSA-N
SMILES:
NCC1N(Cc2ccccc2)C(=O)c2c1cccc2.Cl
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.103g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
288.775g/mol
Monoisotopic Mass:
288.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties