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36945-08-1 | Butylamine Hydroiodide
CAS No: 36945-08-1 Catalog No: AG0039BX MDL No:
Product Description
Catalog Number:
AG0039BX
Chemical Name:
Butylamine Hydroiodide
CAS Number:
36945-08-1
Molecular Formula:
C4H12IN
Molecular Weight:
201.0493
IUPAC Name:
butan-1-amine;hydroiodide
InChI:
InChI=1S/C4H11N.HI/c1-2-3-4-5;/h2-5H2,1H3;1H
InChI Key:
CALQKRVFTWDYDG-UHFFFAOYSA-N
SMILES:
CCCCN.I
Properties
Complexity:
13.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.001g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.051g/mol
Monoisotopic Mass:
201.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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