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143770-93-8 | 3-Phospholanol, 2-bromo-1-ethoxy-, 1-oxide
CAS No: 143770-93-8 Catalog No: AG001IBQ MDL No:
Product Description
Catalog Number:
AG001IBQ
Chemical Name:
3-Phospholanol, 2-bromo-1-ethoxy-, 1-oxide
CAS Number:
143770-93-8
Molecular Formula:
C6H12BrO3P
Molecular Weight:
243.0354
IUPAC Name:
2-bromo-1-ethoxy-1-oxo-1λ5-phospholan-3-ol
InChI:
InChI=1S/C6H12BrO3P/c1-2-10-11(9)4-3-5(8)6(11)7/h5-6,8H,2-4H2,1H3
InChI Key:
OEOOAIZTWTWSRD-UHFFFAOYSA-N
SMILES:
CCOP1(=O)CCC(C1Br)O
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.971g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.037g/mol
Monoisotopic Mass:
241.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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