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210880-91-4

210880-91-4 | 1,3-Benzenediol, 5-(dibutylamino)-

CAS No: 210880-91-4 Catalog No: AG002L0I MDL No:

Product Description

Catalog Number:
AG002L0I
Chemical Name:
1,3-Benzenediol, 5-(dibutylamino)-
CAS Number:
210880-91-4
Molecular Formula:
C14H23NO2
Molecular Weight:
237.3379
IUPAC Name:
5-(dibutylamino)benzene-1,3-diol
InChI:
InChI=1S/C14H23NO2/c1-3-5-7-15(8-6-4-2)12-9-13(16)11-14(17)10-12/h9-11,16-17H,3-8H2,1-2H3
InChI Key:
VBJBPWOTBNZYDG-UHFFFAOYSA-N
SMILES:
CCCCN(c1cc(O)cc(c1)O)CCCC

Properties

Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.173g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.343g/mol
Monoisotopic Mass:
237.173g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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