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102714-66-9 | Butanedioic acid, methylmethylene-, (S)- (9CI)
CAS No: 102714-66-9 Catalog No: AG00087Q MDL No:
Product Description
Catalog Number:
AG00087Q
Chemical Name:
Butanedioic acid, methylmethylene-, (S)- (9CI)
CAS Number:
102714-66-9
IUPAC Name:
2-ethylidenebutanedioic acid
InChI:
InChI=1S/C6H8O4/c1-2-4(6(9)10)3-5(7)8/h2H,3H2,1H3,(H,7,8)(H,9,10)
InChI Key:
NRSMWHGLCNBZSO-UHFFFAOYSA-N
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| Searching for intermediates in the carbon skeleton rearrangement of 2-methyleneglutarate to (R)-3-methylitaconate catalyzed by coenzyme B12-dependent 2-methyleneglutarate mutase from Eubacterium barkeri. | Biochemistry 20050809 |
| Transdermal application of bupivacaine-loaded poly(acrylamide(A)-co-monomethyl itaconate) hydrogels. | International journal of pharmaceutics 20030414 |
| Rotation of the exo-methylene group of (R)-3-methylitaconate catalyzed by coenzyme B(12)-dependent 2-methyleneglutarate mutase from Eubacterium barkeri. | Journal of the American Chemical Society 20021127 |
| A novel reaction between adenosylcobalamin and 2-methyleneglutarate catalyzed by glutamate mutase. | Biochemistry 20020305 |
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