200,000+ products from a single source!
sales@angenechem.com
88702-62-9 | 5-Hepten-1-yn-3-amine, 1-(4-chlorophenyl)-N,N-dimethyl-
CAS No: 88702-62-9 Catalog No: AG0046E4 MDL No:
Product Description
Catalog Number:
AG0046E4
Chemical Name:
5-Hepten-1-yn-3-amine, 1-(4-chlorophenyl)-N,N-dimethyl-
CAS Number:
88702-62-9
Molecular Formula:
C15H18ClN
Molecular Weight:
247.7631
IUPAC Name:
1-(4-chlorophenyl)-N,N-dimethylhept-5-en-1-yn-3-amine
InChI:
InChI=1S/C15H18ClN/c1-4-5-6-15(17(2)3)12-9-13-7-10-14(16)11-8-13/h4-5,7-8,10-11,15H,6H2,1-3H3
InChI Key:
VYTITDHLTJLIPG-UHFFFAOYSA-N
SMILES:
CC=CCC(N(C)C)C#Cc1ccc(cc1)Cl
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.113g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.766g/mol
Monoisotopic Mass:
247.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.