Home Halogens 2,6-di-tert-butyl-4-chlorophenol

2,6-di-tert-butyl-4-chlorophenol

CAS No.:
4096-72-4
Catalog Number:
AG00CVTL
Molecular Formula:
C14H21ClO
Molecular Weight:
240.7689
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Product Description
Catalog Number:
AG00CVTL
Chemical Name:
2,6-di-tert-butyl-4-chlorophenol
CAS Number:
4096-72-4
Molecular Formula:
C14H21ClO
Molecular Weight:
240.7689
MDL Number:
MFCD00087733
IUPAC Name:
2,6-ditert-butyl-4-chlorophenol
InChI:
InChI=1S/C14H21ClO/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8,16H,1-6H3
InChI Key:
WLQMYDWPKCQDPQ-UHFFFAOYSA-N
SMILES:
Clc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
EC Number:
223-851-1
UNII:
1Q5NLT427A
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.128g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.771g/mol
Monoisotopic Mass:
240.128g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  
Properties