Home Other Building Blocks 1-phenyl-2-(pyrrolidin-1-yl)ethan-1-one hydrochloride

1-phenyl-2-(pyrrolidin-1-yl)ethan-1-one hydrochloride

CAS No.:
2218-16-8
Catalog Number:
AG01EJVO
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
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Product Description
Catalog Number:
AG01EJVO
Chemical Name:
1-phenyl-2-(pyrrolidin-1-yl)ethan-1-one hydrochloride
CAS Number:
2218-16-8
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
MDL Number:
MFCD27959682
IUPAC Name:
1-phenyl-2-pyrrolidin-1-ylethanone;hydrochloride
InChI:
InChI=1S/C12H15NO.ClH/c14-12(10-13-8-4-5-9-13)11-6-2-1-3-7-11;/h1-3,6-7H,4-5,8-10H2;1H
InChI Key:
HTTVGHCPCMYIGL-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CN1CCCC1.Cl
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties