Home Other Building Blocks 2,3-dimethylbut-3-en-1-ol

2,3-dimethylbut-3-en-1-ol

CAS No.:
1708-93-6
Catalog Number:
AG01BS9H
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
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Product Description
Catalog Number:
AG01BS9H
Chemical Name:
2,3-dimethylbut-3-en-1-ol
CAS Number:
1708-93-6
Molecular Formula:
C6H12O
Molecular Weight:
100.1589
MDL Number:
MFCD22054970
IUPAC Name:
2,3-dimethylbut-3-en-1-ol
InChI:
InChI=1S/C6H12O/c1-5(2)6(3)4-7/h6-7H,1,4H2,2-3H3
InChI Key:
OSUIFWPTEFZCMB-UHFFFAOYSA-N
SMILES:
CC(C(=C)C)CO
Properties
Complexity:
66.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.089g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
100.161g/mol
Monoisotopic Mass:
100.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties