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2450-71-7 | 2-Propyn-1-amine
CAS No: 2450-71-7 Catalog No: AG002OCW MDL No:MFCD00008198
Product Description
Catalog Number:
AG002OCW
Chemical Name:
2-Propyn-1-amine
CAS Number:
2450-71-7
Molecular Formula:
C3H5N
Molecular Weight:
55.0785
MDL Number:
MFCD00008198
IUPAC Name:
prop-2-yn-1-amine
InChI:
InChI=1S/C3H5N/c1-2-3-4/h1H,3-4H2
InChI Key:
JKANAVGODYYCQF-UHFFFAOYSA-N
SMILES:
NCC#C
EC Number:
219-513-8
NSC Number:
80642
Properties
Complexity:
38.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
55.042g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
55.08g/mol
Monoisotopic Mass:
55.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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