Home Other Building Blocks 3,5-Di-tert-butylcatechol

3,5-Di-tert-butylcatechol

CAS No.:
1020-31-1
Catalog Number:
AG000692
Molecular Formula:
C14H22O2
Molecular Weight:
222.3233
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$44
- +
25g
95%
In Stock USA
United States
$119
- +
100g
95%
In Stock USA
United States
$390
- +
500g
95%
In Stock USA
United States
$1663
- +
Product Description
Catalog Number:
AG000692
Chemical Name:
3,5-Di-tert-butylcatechol
CAS Number:
1020-31-1
Molecular Formula:
C14H22O2
Molecular Weight:
222.3233
MDL Number:
MFCD00008819
IUPAC Name:
3,5-ditert-butylbenzene-1,2-diol
InChI:
InChI=1S/C14H22O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8,15-16H,1-6H3
InChI Key:
PJZLSMMERMMQBJ-UHFFFAOYSA-N
SMILES:
Oc1cc(cc(c1O)C(C)(C)C)C(C)(C)C
EC Number:
213-816-9
UNII:
1328KN3F8B
NSC Number:
59767
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.162g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
222.328g/mol
Monoisotopic Mass:
222.162g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Literature
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Properties