Home Halogens {1-[2-bromo-4-(trifluoromethyl)phenyl]azetidin-3-yl}methanol

{1-[2-bromo-4-(trifluoromethyl)phenyl]azetidin-3-yl}methanol

CAS No.:
1550559-95-9
Catalog Number:
AG01BANI
Molecular Formula:
C11H11BrF3NO
Molecular Weight:
310.1103
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Product Description
Catalog Number:
AG01BANI
Chemical Name:
{1-[2-bromo-4-(trifluoromethyl)phenyl]azetidin-3-yl}methanol
CAS Number:
1550559-95-9
Molecular Formula:
C11H11BrF3NO
Molecular Weight:
310.1103
MDL Number:
MFCD23669235
IUPAC Name:
[1-[2-bromo-4-(trifluoromethyl)phenyl]azetidin-3-yl]methanol
InChI:
InChI=1S/C11H11BrF3NO/c12-9-3-8(11(13,14)15)1-2-10(9)16-4-7(5-16)6-17/h1-3,7,17H,4-6H2
InChI Key:
FXAXPHXPWIYIIN-UHFFFAOYSA-N
SMILES:
OCC1CN(C1)c1ccc(cc1Br)C(F)(F)F
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.998g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
310.114g/mol
Monoisotopic Mass:
308.998g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties