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89455-92-5

89455-92-5 | 2-Pentanol, 5-(tetrahydro-2H-pyran-2-ylidene)-

CAS No: 89455-92-5 Catalog No: AG0042MR MDL No:

Product Description

Catalog Number:
AG0042MR
Chemical Name:
2-Pentanol, 5-(tetrahydro-2H-pyran-2-ylidene)-
CAS Number:
89455-92-5
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
IUPAC Name:
5-(oxan-2-ylidene)pentan-2-ol
InChI:
InChI=1S/C10H18O2/c1-9(11)5-4-7-10-6-2-3-8-12-10/h7,9,11H,2-6,8H2,1H3
InChI Key:
ZQPAGHHVNLMTIF-UHFFFAOYSA-N
SMILES:
CC(CCC=C1CCCCO1)O

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.8  

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