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139492-26-5 | 1-Octyn-3-ol, 1-(trimethylsilyl)-, formate, (R)- (9CI)
CAS No: 139492-26-5 Catalog No: AG001B4P MDL No:
Product Description
Catalog Number:
AG001B4P
Chemical Name:
1-Octyn-3-ol, 1-(trimethylsilyl)-, formate, (R)- (9CI)
CAS Number:
139492-26-5
Molecular Formula:
C12H22O2Si
Molecular Weight:
226.3874
IUPAC Name:
formic acid;1-trimethylsilyloct-1-yn-3-ol
InChI:
InChI=1S/C11H22OSi.CH2O2/c1-5-6-7-8-11(12)9-10-13(2,3)4;2-1-3/h11-12H,5-8H2,1-4H3;1H,(H,2,3)
InChI Key:
NFNPUQCLTYBLES-UHFFFAOYSA-N
SMILES:
CCCCC[C@H](C#C[Si](C)(C)C)OC=O
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.149g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
244.406g/mol
Monoisotopic Mass:
244.149g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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