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137688-21-2 | Oxirane, 2-(3-buten-1-yl)-, (2S)-
CAS No: 137688-21-2 Catalog No: AG0013QP MDL No:MFCD17926427
Product Description
Catalog Number:
AG0013QP
Chemical Name:
Oxirane, 2-(3-buten-1-yl)-, (2S)-
CAS Number:
137688-21-2
Molecular Formula:
C6H10O
Molecular Weight:
98.1430
MDL Number:
MFCD17926427
IUPAC Name:
(2S)-2-but-3-enyloxirane
InChI:
InChI=1S/C6H10O/c1-2-3-4-6-5-7-6/h2,6H,1,3-5H2/t6-/m0/s1
InChI Key:
MUUOUUYKIVSIAR-LURJTMIESA-N
SMILES:
C=CCC[C@H]1CO1
EC Number:
604-034-2
Properties
Complexity:
68.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
98.073g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.145g/mol
Monoisotopic Mass:
98.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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