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2050-50-2 | 1-Propanol, 2-(dibutylamino)-
CAS No: 2050-50-2 Catalog No: AG0029T1 MDL No:
Product Description
Catalog Number:
AG0029T1
Chemical Name:
1-Propanol, 2-(dibutylamino)-
CAS Number:
2050-50-2
Molecular Formula:
C11H25NO
Molecular Weight:
187.3223
IUPAC Name:
2-(dibutylamino)propan-1-ol
InChI:
InChI=1S/C11H25NO/c1-4-6-8-12(9-7-5-2)11(3)10-13/h11,13H,4-10H2,1-3H3
InChI Key:
OBMOTNPABSFLBC-UHFFFAOYSA-N
SMILES:
CCCCN(C(CO)C)CCCC
NSC Number:
8783
Properties
Complexity:
98.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.194g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.327g/mol
Monoisotopic Mass:
187.194g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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