Home Other Building Blocks Acetic acid, 2-[2,4-bis(1,1-dimethylethyl)phenoxy]-

Acetic acid, 2-[2,4-bis(1,1-dimethylethyl)phenoxy]-

CAS No.:
18327-79-2
Catalog Number:
AG0027H1
Molecular Formula:
C16H24O3
Molecular Weight:
264.3600
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Product Description
Catalog Number:
AG0027H1
Chemical Name:
Acetic acid, 2-[2,4-bis(1,1-dimethylethyl)phenoxy]-
CAS Number:
18327-79-2
Molecular Formula:
C16H24O3
Molecular Weight:
264.3600
MDL Number:
MFCD00514873
IUPAC Name:
2-(2,4-ditert-butylphenoxy)acetic acid
InChI:
InChI=1S/C16H24O3/c1-15(2,3)11-7-8-13(19-10-14(17)18)12(9-11)16(4,5)6/h7-9H,10H2,1-6H3,(H,17,18)
InChI Key:
ZKEWJHKMOWKCFM-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1C(C)(C)C)C(C)(C)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.173g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.365g/mol
Monoisotopic Mass:
264.173g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties