Home Halogens 3-amino-3-(4-chloro-3-fluorophenyl)propan-1-ol

3-amino-3-(4-chloro-3-fluorophenyl)propan-1-ol

CAS No.:
787615-38-7
Catalog Number:
AG01BXWT
Molecular Formula:
C9H11ClFNO
Molecular Weight:
203.6411
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Product Description
Catalog Number:
AG01BXWT
Chemical Name:
3-amino-3-(4-chloro-3-fluorophenyl)propan-1-ol
CAS Number:
787615-38-7
Molecular Formula:
C9H11ClFNO
Molecular Weight:
203.6411
MDL Number:
MFCD06227495
IUPAC Name:
3-amino-3-(4-chloro-3-fluorophenyl)propan-1-ol
InChI:
InChI=1S/C9H11ClFNO/c10-7-2-1-6(5-8(7)11)9(12)3-4-13/h1-2,5,9,13H,3-4,12H2
InChI Key:
FEFLEQVGCBGMTC-UHFFFAOYSA-N
SMILES:
OCCC(c1ccc(c(c1)F)Cl)N
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
203.641g/mol
Monoisotopic Mass:
203.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties