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4160-82-1,MFCD00006684
Catalog No.:AA003IAR
4160-82-1 | 3,3-Dimethylglutaric anhydride
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1g
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5g
98%
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25g
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA003IAR
Chemical Name:
3,3-Dimethylglutaric anhydride
CAS Number:
4160-82-1
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
MDL Number:
MFCD00006684
IUPAC Name:
4,4-dimethyloxane-2,6-dione
InChI:
InChI=1S/C7H10O3/c1-7(2)3-5(8)10-6(9)4-7/h3-4H2,1-2H3
InChI Key:
HIJQFTSZBHDYKW-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)CC(C1)(C)C
EC Number:
223-998-1
UNII:
U3BON0TR03
NSC Number:
2827
Properties
Computed Properties
 
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

Synonyms
 
3,3-Dimethylglutaric anhydride 
4160-82-1 
HIJQFTSZBHDYKW-UHFFFAOYSA-N 
NSC2827 
NSC 2827 
EINECS 223-998-1 
Glutaric anhydride, beta,beta-dimethyl- 
ACMC-1ADVE 
AI3-11032 
AC1L2TVE 
AC1Q2CKG 
AC1Q6H9L 
4,4-Dimethyldihydro-2H-pyran-2,6(3H)-dione 
Dihydro-4,4-dimethyl-2H-pyran-2,6(3H)-dione 
3,3-Dimethyladipic anhydride 
SCHEMBL159517 
3,3 Dimethylglutaric anhydride 
Glutaric anhydride,3-dimethyl- 
3,3-dimethyl glutaric anhydride 
DTXSID4063327 
CTK4I5023 
3',3'-Dimethylglutaric anhydride 
KS-000013PR 
4,4-dimethyloxane-2,6-dione 
NSC-2827 
Glutaric anhydride,.beta.-dimethyl- 
ANW-29647 
BBL005440 
STL124109 
ZINC95738306 
2H-Pyran-2, dihydro-4,4-dimethyl- 
3,3-Dimethylglutaric anhydride, 99% 
AKOS005716885 
MCULE-1747312582 
2H-Pyran-2,6(3H)-dione, dihydro-4,4-dimethyl- 
NE37514 
4,4-dimethyl-dihydro-pyran-2,6-dione 
.beta.,.beta.-Dimethylglutaric anhydride 
AS-47615 
BETA, beta-DIMETHYLGLUTARIC ANHYDRIDE 
DB-050780 
TC-118392 
D1323 
FT-0614080 
Glutaric anhydride, .beta.,.beta.-dimethyl- 
MFCD00006684 
2H-Pyran-2,6(3H)-dione,dihydro-4,4-dimethyl- 
4,4-Dimethyldihydro-2H-pyran-2,6(3H)-dione # 
I14-50272 
InChI=1/C7H10O3/c1-7(2)3-5(8)10-6(9)4-7/h3-4H2,1-2H 
C7H10O3 
CID77813 
AR-1F7936 
C7-H10-O3 
3,3-dimethyltetrahydro-2H-pyran-2,6-dione 
Glutaric anhydride, 3,3-dimethyl- 
UNII-U3BON0TR03 
U3BON0TR03 
3,3-Dimethylglutaricanhydride 
Literature

Title: Synergistic organocatalysis in the kinetic resolution of secondary thiols with concomitant desymmetrization of an anhydride.

Journal: Nature chemistry 20100501

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