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61049-67-0,MFCD14156109
Catalog No.:AA003IW1
61049-67-0 | 3-(Benzyloxy)-4H-pyran-4-one
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$86.00   $60.00
- +
250mg
98%
in stock  
$129.00   $90.00
- +
1g
98%
in stock  
$381.00   $267.00
- +
5g
98%
in stock  
$1,334.00   $934.00
- +
10g
98%
in stock  
$2,381.00   $1,667.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IW1
Chemical Name:
3-(Benzyloxy)-4H-pyran-4-one
CAS Number:
61049-67-0
Molecular Formula:
C12H10O3
Molecular Weight:
202.2060
MDL Number:
MFCD14156109
IUPAC Name:
3-phenylmethoxypyran-4-one
InChI:
InChI=1S/C12H10O3/c13-11-6-7-14-9-12(11)15-8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChI Key:
MKMZYQOQNQAGSX-UHFFFAOYSA-N
SMILES:
O=c1ccocc1OCc1ccccc1
Properties
Computed Properties
 
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.063g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.209g/mol
Monoisotopic Mass:
202.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
3-(Benzyloxy)-4H-pyran-4-one 
61049-67-0 
CTK2E7962 
DTXSID10447664 
MKMZYQOQNQAGSX-UHFFFAOYSA-N 
9136AB 
ANW-65025 
MFCD14156109 
ZINC14507779 
AKOS016005069 
CS-W006414 
DS-4038 
3-benzyloxy-4-pyrone 
FCH1732769 
TRA0023669 
KS-000000M8 
AJ-64934 
CJ-14559 
AX8234730 
TC-020868 
4CH-025183 
ST24041536 
C12H10O3 
4H-Pyran-4-one, 3-(phenylmethoxy)- 
CID10899678 
AK103191 
3-phenylmethoxypyran-4-one 
3-benzyloxy4-pyrone 
ACMC-20aavn 
5-benzyloxy-4h-pyran-4-one 
SCHEMBL2433094 
Literature
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