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4543-53-7 | 3aH,4H,5H,6aH-furo[3,2-d][1,2]oxazole
CAS No: 4543-53-7 Catalog No: AG01AN8E MDL No:MFCD29034184
Product Description
Catalog Number:
AG01AN8E
Chemical Name:
3aH,4H,5H,6aH-furo[3,2-d][1,2]oxazole
CAS Number:
4543-53-7
Molecular Formula:
C5H7NO2
Molecular Weight:
113.1146
MDL Number:
MFCD29034184
IUPAC Name:
3a,4,5,6a-tetrahydrofuro[3,2-d][1,2]oxazole
InChI:
InChI=1S/C5H7NO2/c1-2-7-5-4(1)3-6-8-5/h3-5H,1-2H2
InChI Key:
ZFYNJQXCKVFPIH-UHFFFAOYSA-N
SMILES:
C1OC2C(C1)C=NO2
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.048g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
113.116g/mol
Monoisotopic Mass:
113.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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