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440356-63-8 | 3H,6H-Furo[3,4-c]isoxazol-6-one,tetrahydro-1,4-dimethyl-,(3aS,4R,6aS)-(9CI)
CAS No: 440356-63-8 Catalog No: AG00DX36 MDL No:
Product Description
Catalog Number:
AG00DX36
Chemical Name:
3H,6H-Furo[3,4-c]isoxazol-6-one,tetrahydro-1,4-dimethyl-,(3aS,4R,6aS)-(9CI)
CAS Number:
440356-63-8
IUPAC Name:
(3aS,4R,6aS)-1,4-dimethyl-3,3a,4,6a-tetrahydrofuro[3,4-c][1,2]oxazol-6-one
InChI:
InChI=1S/C7H11NO3/c1-4-5-3-10-8(2)6(5)7(9)11-4/h4-6H,3H2,1-2H3/t4-,5+,6+/m1/s1
InChI Key:
NPENHFBMQGMLAH-SRQIZXRXSA-N
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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