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305805-77-0 | 3-Pentyn-2-ol, 5-(4-fluorophenoxy)-
CAS No: 305805-77-0 Catalog No: AG0030KV MDL No:
Product Description
Catalog Number:
AG0030KV
Chemical Name:
3-Pentyn-2-ol, 5-(4-fluorophenoxy)-
CAS Number:
305805-77-0
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
IUPAC Name:
5-(4-fluorophenoxy)pent-3-yn-2-ol
InChI:
InChI=1S/C11H11FO2/c1-9(13)3-2-8-14-11-6-4-10(12)5-7-11/h4-7,9,13H,8H2,1H3
InChI Key:
ZXTYUTKVQRUBMQ-UHFFFAOYSA-N
SMILES:
CC(C#CCOc1ccc(cc1)F)O
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.205g/mol
Monoisotopic Mass:
194.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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