Home Halogens Isoquinoline,1-(chloromethyl)-3,4-dihydro-

Isoquinoline,1-(chloromethyl)-3,4-dihydro-

CAS No.:
36177-79-4
Catalog Number:
AG007B7L
Molecular Formula:
C10H10ClN
Molecular Weight:
179.6461
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Product Description
Catalog Number:
AG007B7L
Chemical Name:
Isoquinoline,1-(chloromethyl)-3,4-dihydro-
CAS Number:
36177-79-4
Molecular Formula:
C10H10ClN
Molecular Weight:
179.6461
MDL Number:
MFCD02656534
IUPAC Name:
1-(chloromethyl)-3,4-dihydroisoquinoline
InChI:
InChI=1S/C10H10ClN/c11-7-10-9-4-2-1-3-8(9)5-6-12-10/h1-4H,5-7H2
InChI Key:
DJHLUJYURNDBRN-UHFFFAOYSA-N
SMILES:
ClCC1=NCCc2c1cccc2
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.05g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.647g/mol
Monoisotopic Mass:
179.05g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties