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1257740-52-5 | Boron, [2-(bromomethyl)phenyl][N-[(carboxy-κO)methyl]-N-methylglycinato(2-)-κN,κO]-, (T-4)-
CAS No: 1257740-52-5 Catalog No: AG000OOP MDL No:
Product Description
Catalog Number:
AG000OOP
Chemical Name:
Boron, [2-(bromomethyl)phenyl][N-[(carboxy-κO)methyl]-N-methylglycinato(2-)-κN,κO]-, (T-4)-
CAS Number:
1257740-52-5
IUPAC Name:
2-[2-(bromomethyl)phenyl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
InChI:
InChI=1S/C12H13BBrNO4/c1-15-7-11(16)18-13(19-12(17)8-15)10-5-3-2-4-9(10)6-14/h2-5H,6-8H2,1H3
InChI Key:
GUOSLMTXTQNEPM-UHFFFAOYSA-N
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.012g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.953g/mol
Monoisotopic Mass:
325.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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