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105658-49-9

105658-49-9 | 3-(3-Methylisoxazol-5-yl);propan-1-ol

CAS No: 105658-49-9 Catalog No: AG00846O MDL No:MFCD04972527

Product Description

Catalog Number:
AG00846O
Chemical Name:
3-(3-Methylisoxazol-5-yl);propan-1-ol
CAS Number:
105658-49-9
Molecular Formula:
C7H11NO2
Molecular Weight:
141.1677
MDL Number:
MFCD04972527
IUPAC Name:
3-(3-methyl-1,2-oxazol-5-yl)propan-1-ol
InChI:
InChI=1S/C7H11NO2/c1-6-5-7(10-8-6)3-2-4-9/h5,9H,2-4H2,1H3
InChI Key:
WLKCJYLGRDETLU-UHFFFAOYSA-N
SMILES:
Cc1cc(on1)CCCO

Properties

Complexity:
97.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.17g/mol
Monoisotopic Mass:
141.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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