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3416-74-8 | 1-Chloronon-4-yne
CAS No: 3416-74-8 Catalog No: AG003E88 MDL No:
Product Description
Catalog Number:
AG003E88
Chemical Name:
1-Chloronon-4-yne
CAS Number:
3416-74-8
Molecular Formula:
C9H15Cl
Molecular Weight:
158.6684
IUPAC Name:
1-chloronon-4-yne
InChI:
InChI=1S/C9H15Cl/c1-2-3-4-5-6-7-8-9-10/h2-4,7-9H2,1H3
InChI Key:
RHZYERSKMQJUCP-UHFFFAOYSA-N
SMILES:
CCCCC#CCCCCl
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.086g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.669g/mol
Monoisotopic Mass:
158.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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