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

[(2-chloro-4-fluorophenyl)methyl](cyclopropylmethyl)amine

CAS No.:
1020979-51-4
Catalog Number:
AG01BACH
Molecular Formula:
C11H13ClFN
Molecular Weight:
213.6790
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Product Description
Catalog Number:
AG01BACH
Chemical Name:
[(2-chloro-4-fluorophenyl)methyl](cyclopropylmethyl)amine
CAS Number:
1020979-51-4
Molecular Formula:
C11H13ClFN
Molecular Weight:
213.6790
MDL Number:
MFCD11150464
IUPAC Name:
N-[(2-chloro-4-fluorophenyl)methyl]-1-cyclopropylmethanamine
InChI:
InChI=1S/C11H13ClFN/c12-11-5-10(13)4-3-9(11)7-14-6-8-1-2-8/h3-5,8,14H,1-2,6-7H2
InChI Key:
ACHYLPLFUTWDSK-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)CNCC1CC1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.072g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.68g/mol
Monoisotopic Mass:
213.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties