Home Other Building Blocks 2-tert-butyloxan-4-ol

2-tert-butyloxan-4-ol

CAS No.:
1339588-58-7
Catalog Number:
AG01BTQH
Molecular Formula:
C9H18O2
Molecular Weight:
158.2380
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Product Description
Catalog Number:
AG01BTQH
Chemical Name:
2-tert-butyloxan-4-ol
CAS Number:
1339588-58-7
Molecular Formula:
C9H18O2
Molecular Weight:
158.2380
MDL Number:
MFCD19650636
IUPAC Name:
2-tert-butyloxan-4-ol
InChI:
InChI=1S/C9H18O2/c1-9(2,3)8-6-7(10)4-5-11-8/h7-8,10H,4-6H2,1-3H3
InChI Key:
FKIAORYWWSODLH-UHFFFAOYSA-N
SMILES:
OC1CCOC(C1)C(C)(C)C
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.131g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
158.241g/mol
Monoisotopic Mass:
158.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties