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116530-59-7 | 2-Butanol, 4-[(2-hydroxyethyl)amino]-
CAS No: 116530-59-7 Catalog No: AG000CP6 MDL No:
Product Description
Catalog Number:
AG000CP6
Chemical Name:
2-Butanol, 4-[(2-hydroxyethyl)amino]-
CAS Number:
116530-59-7
Molecular Formula:
C6H15NO2
Molecular Weight:
133.1888
IUPAC Name:
4-(2-hydroxyethylamino)butan-2-ol
InChI:
InChI=1S/C6H15NO2/c1-6(9)2-3-7-4-5-8/h6-9H,2-5H2,1H3
InChI Key:
DDDKYDUQCUEVQP-UHFFFAOYSA-N
SMILES:
OCCNCCC(O)C
Properties
Complexity:
59
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.11g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
133.191g/mol
Monoisotopic Mass:
133.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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