Home Other Building Blocks 1-phenylprop-2-yn-1-amine hydrochloride

1-phenylprop-2-yn-1-amine hydrochloride

CAS No.:
157022-35-0
Catalog Number:
AG01BGCJ
Molecular Formula:
C9H10ClN
Molecular Weight:
167.6354
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Product Description
Catalog Number:
AG01BGCJ
Chemical Name:
1-phenylprop-2-yn-1-amine hydrochloride
CAS Number:
157022-35-0
Molecular Formula:
C9H10ClN
Molecular Weight:
167.6354
MDL Number:
MFCD00600875
IUPAC Name:
1-phenylprop-2-yn-1-amine;hydrochloride
InChI:
InChI=1S/C9H9N.ClH/c1-2-9(10)8-6-4-3-5-7-8;/h1,3-7,9H,10H2;1H
InChI Key:
LEEITMHLSCHFFT-UHFFFAOYSA-N
SMILES:
NC(c1ccccc1)C#C.Cl
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.05g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.636g/mol
Monoisotopic Mass:
167.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties