Home Other Building Blocks (1-phenylpropan-2-yl)(prop-2-yn-1-yl)amine hydrochloride

(1-phenylpropan-2-yl)(prop-2-yn-1-yl)amine hydrochloride

CAS No.:
2588-96-7
Catalog Number:
AG019S2A
Molecular Formula:
C12H16ClN
Molecular Weight:
209.7151
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Product Description
Catalog Number:
AG019S2A
Chemical Name:
(1-phenylpropan-2-yl)(prop-2-yn-1-yl)amine hydrochloride
CAS Number:
2588-96-7
Molecular Formula:
C12H16ClN
Molecular Weight:
209.7151
MDL Number:
MFCD01708009
IUPAC Name:
1-phenyl-N-prop-2-ynylpropan-2-amine;hydrochloride
InChI:
InChI=1S/C12H15N.ClH/c1-3-9-13-11(2)10-12-7-5-4-6-8-12;/h1,4-8,11,13H,9-10H2,2H3;1H
InChI Key:
KJZZTCSJZCYCQS-UHFFFAOYSA-N
SMILES:
CC(Cc1ccccc1)NCC#C.Cl
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.097g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.717g/mol
Monoisotopic Mass:
209.097g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties