200,000+ products from a single source!
sales@angenechem.com
114421-86-2 | Oxiranemethanol, 3-[[(4-bromophenyl)methoxy]methyl]-, (2R,3R)-rel- (9CI)
CAS No: 114421-86-2 Catalog No: AG000BBA MDL No:
Product Description
Catalog Number:
AG000BBA
Chemical Name:
Oxiranemethanol, 3-[[(4-bromophenyl)methoxy]methyl]-, (2R,3R)-rel- (9CI)
CAS Number:
114421-86-2
Molecular Formula:
C11H13BrO3
Molecular Weight:
273.1231
IUPAC Name:
[3-[(4-bromophenyl)methoxymethyl]oxiran-2-yl]methanol
InChI:
InChI=1S/C11H13BrO3/c12-9-3-1-8(2-4-9)6-14-7-11-10(5-13)15-11/h1-4,10-11,13H,5-7H2
InChI Key:
PECBWSBCNVSTRY-UHFFFAOYSA-N
SMILES:
OC[C@H]1O[C@@H]1COCc1ccc(cc1)Br
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.005g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.126g/mol
Monoisotopic Mass:
272.005g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.