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837375-15-2 | 2-Oxazolidinone, 4-[(1R,2E)-1-hydroxy-2-butenyl]-, (4S)-
CAS No: 837375-15-2 Catalog No: AG004SR5 MDL No:
Product Description
Catalog Number:
AG004SR5
Chemical Name:
2-Oxazolidinone, 4-[(1R,2E)-1-hydroxy-2-butenyl]-, (4S)-
CAS Number:
837375-15-2
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
IUPAC Name:
(4S)-4-[(1R)-1-hydroxybut-2-enyl]-1,3-oxazolidin-2-one
InChI:
InChI=1S/C7H11NO3/c1-2-3-6(9)5-4-11-7(10)8-5/h2-3,5-6,9H,4H2,1H3,(H,8,10)/t5-,6+/m0/s1
InChI Key:
DNVLPZUOEMNHDR-NTSWFWBYSA-N
SMILES:
C/C=C/[C@H]([C@@H]1COC(=O)N1)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0
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