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137020-06-5 | 1-Butanol, 4-[(2-aminoethyl)amino]-
CAS No: 137020-06-5 Catalog No: AG0012QB MDL No:
Product Description
Catalog Number:
AG0012QB
Chemical Name:
1-Butanol, 4-[(2-aminoethyl)amino]-
CAS Number:
137020-06-5
Molecular Formula:
C6H16N2O
Molecular Weight:
132.2040
IUPAC Name:
4-(2-aminoethylamino)butan-1-ol
InChI:
InChI=1S/C6H16N2O/c7-3-5-8-4-1-2-6-9/h8-9H,1-7H2
InChI Key:
BREALZQYMJKZGJ-UHFFFAOYSA-N
SMILES:
NCCNCCCCO
Properties
Complexity:
50.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.126g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
132.207g/mol
Monoisotopic Mass:
132.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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