Home Aldehydes 3-tert-Butyl-2-hydroxybenzaldehyde

3-tert-Butyl-2-hydroxybenzaldehyde

CAS No.:
24623-65-2
Catalog Number:
AG002OTJ
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$63
- +
100g
98%
In Stock USA
United States
$169
- +
Product Description
Catalog Number:
AG002OTJ
Chemical Name:
3-tert-Butyl-2-hydroxybenzaldehyde
CAS Number:
24623-65-2
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD00778877
IUPAC Name:
3-tert-butyl-2-hydroxybenzaldehyde
InChI:
InChI=1S/C11H14O2/c1-11(2,3)9-6-4-5-8(7-12)10(9)13/h4-7,13H,1-3H3
InChI Key:
ROILLNJICXGZQQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1O)C(C)(C)C
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
2-tert-Butyl-6-(cyclo-hexyl-imino-meth-yl)-4-meth-oxy-phenol. Acta crystallographica. Section E, Structure reports online 20110701
Properties