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40114-49-6,MFCD00023277
Catalog No.:AA00I7SJ
40114-49-6 | 3-Piperidinone, 1-(phenylmethyl)-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$40.00
- +
5g
96%
in stock  
$134.00
- +
10g
96%
in stock  
$234.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA00I7SJ
Chemical Name:
3-Piperidinone, 1-(phenylmethyl)-
CAS Number:
40114-49-6
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD00023277
IUPAC Name:
1-benzylpiperidin-3-one
InChI:
InChI=1S/C12H15NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2
InChI Key:
BBQQULRBTOMLTC-UHFFFAOYSA-N
SMILES:
O=C1CCCN(C1)Cc1ccccc1
NSC Number:
84168
Properties
Computed Properties
 
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
1-benzylpiperidin-3-one 
40114-49-6 
1-benyl-3-piperidinone 
l-benzyl-3-piperidinone 
AC1Q6KTJ 
1-Benzyl-3-piperidonehydrochloridemonohydrate 
1-benzyl-piperidin-3-one 
1-Benzyl-piperidine-3-one 
AC1L3WX3 
SCHEMBL568477 
CTK4I2479 
DTXSID10193154 
1-Benzyl-3-piperidone 
BBQQULRBTOMLTC-UHFFFAOYSA-N 
ZINC119573 
ALBB-006393 
BCP23222 
KS-00000JD7 
1-benzyltetrahydro-3(2H)-pyridinone 
ANW-48124 
BBL018022 
MFCD00023277 
NSC-84168 
1-Benzyl-3-piperidinone 
SBB048189 
STK503890 
AKOS000265072 
BS-4037 
CM14328 
MCULE-1491933986 
RP24921 
SB10200 
AC-15327 
AJ-11595 
3-Piperidinone, 1-(phenylmethyl)- 
SC-04247 
SC-40507 
AB0024728 
DB-031005 
TX-011524 
A6704 
AM20040403 
BB 0216341 
FT-0647789 
ST24037778 
N-benzyl-3-piperidone 
ST50406577 
W6051 
B13231 
C-5340 
W-202657 
F8880-6296 
1-Benzyl-3-hydroxypiperidine 
C12H15NO 
C12-H15-N-O 
CID96650 
n-benzyl-3-piperidinone 
AR-1C1875 
MFCD00023734 
1-benzylpiperidin-3-one hydrochloride 
1-benzylpiperidin-3-one hydrochloride hydrate 
50606-58-1 
14813-01-5 
5219-65-8 
1-(phenylmethyl)-3-piperidinone 
3-Piperidinone,1-(phenylmethyl)- 
NSC84168 
Literature
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