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10226-28-5,MFCD00143102
Catalog No.:AA0006ZR
10226-28-5 | 3-Ethoxycarbonyl-5,6-dihydro-2-methyl-4H-pyran
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5g
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$192.00   $134.00
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$575.00   $402.00
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Technical Information
Catalog Number:
AA0006ZR
Chemical Name:
3-Ethoxycarbonyl-5,6-dihydro-2-methyl-4H-pyran
CAS Number:
10226-28-5
Molecular Formula:
C9H14O3
Molecular Weight:
170.2057
MDL Number:
MFCD00143102
IUPAC Name:
ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate
InChI:
InChI=1S/C9H14O3/c1-3-11-9(10)8-5-4-6-12-7(8)2/h3-6H2,1-2H3
InChI Key:
BWVSWJMSYLYIJA-UHFFFAOYSA-N
SMILES:
CC1=C(CCCO1)C(=O)OCC
EC Number:
233-543-9
NSC Number:
30277
Properties
Computed Properties
 
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.094g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.208g/mol
Monoisotopic Mass:
170.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
10226-28-5 
Ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate 
AC1L33H1 
SCHEMBL5881177 
BWVSWJMSYLYIJA-UHFFFAOYSA- 
CTK4A0880 
DTXSID30144845 
3,4-Dihydro-6-methyl-2H-pyran-5-carboxylic acid ethyl ester 
ACMC-209815 
ZINC4280890 
7617AC 
ANW-14679 
3-Ethoxycarbonyl-5,6-dihydro-2-methyl-4H-pyran 
MFCD00143102 
NSC-30277 
AKOS003604262 
GS-6697 
AJ-50125 
DB-030680 
TC-103424 
FT-0671619 
3-Ethoxycarbonyl-2-methyl-5,6-dihydro-4H-pyran 
ethyl 2-methyl-5,6-dihydro-4H-pyran-3-carboxylate 
2-Methyl-3-carbethoxy-5,6-dihydropyran 
J-000661 
Ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate # 
I14-99583 
F2147-5237 
2-methyl-5,6-dihydro-4H-pyran-3-carboxylic acid ethyl ester 
6-Methyl-3,4-dihydro-2H-pyran-5-carboxylic acid ethyl ester 
2H-Pyran-5-carboxylicacid, 3,4-dihydro-6-methyl-, ethyl ester 
InChI=1/C9H14O3/c1-3-11-9(10)8-5-4-6-12-7(8)2/h3-6H2,1-2H3 
C9H14O3 
CID82467 
2H-Pyran-5-carboxylic acid, 3,4-dihydro-6-methyl-, ethyl ester 
AR-1I9541 
c1216 
C9-H14-O3 
10282-35-6 
BWVSWJMSYLYIJA-UHFFFAOYSA-N 
Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate 
NSC30277 
EINECS 233-543-9 
AC1Q63MA 
Literature
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