Home Halogens 4-[(2-chloro-4-fluorophenyl)methyl]oxan-4-amine hydrochloride

4-[(2-chloro-4-fluorophenyl)methyl]oxan-4-amine hydrochloride

CAS No.:
1820650-70-1
Catalog Number:
AG01AMNY
Molecular Formula:
C12H16Cl2FNO
Molecular Weight:
280.1659
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Product Description
Catalog Number:
AG01AMNY
Chemical Name:
4-[(2-chloro-4-fluorophenyl)methyl]oxan-4-amine hydrochloride
CAS Number:
1820650-70-1
Molecular Formula:
C12H16Cl2FNO
Molecular Weight:
280.1659
MDL Number:
MFCD29033955
IUPAC Name:
4-[(2-chloro-4-fluorophenyl)methyl]oxan-4-amine;hydrochloride
InChI:
InChI=1S/C12H15ClFNO.ClH/c13-11-7-10(14)2-1-9(11)8-12(15)3-5-16-6-4-12;/h1-2,7H,3-6,8,15H2;1H
InChI Key:
HQXDDQUIEFNRMT-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)CC1(N)CCOCC1.Cl
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.059g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
280.164g/mol
Monoisotopic Mass:
279.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties