Home Other Building Blocks ethyl 2-(hydroxymethyl)-4,4-dimethylpentanoate

ethyl 2-(hydroxymethyl)-4,4-dimethylpentanoate

CAS No.:
107749-64-4
Catalog Number:
AG01AUWD
Molecular Formula:
C10H20O3
Molecular Weight:
188.2640
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Product Description
Catalog Number:
AG01AUWD
Chemical Name:
ethyl 2-(hydroxymethyl)-4,4-dimethylpentanoate
CAS Number:
107749-64-4
Molecular Formula:
C10H20O3
Molecular Weight:
188.2640
MDL Number:
MFCD29047235
IUPAC Name:
ethyl 2-(hydroxymethyl)-4,4-dimethylpentanoate
InChI:
InChI=1S/C10H20O3/c1-5-13-9(12)8(7-11)6-10(2,3)4/h8,11H,5-7H2,1-4H3
InChI Key:
XJDRYDWLAXOYMK-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CC(C)(C)C)CO
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.141g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.267g/mol
Monoisotopic Mass:
188.141g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties