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88073-11-4 | Carbamic acid, [2-(4-bromophenyl)-1-hydroxy-2-oxoethyl]-, methyl ester
CAS No: 88073-11-4 Catalog No: AG004KJY MDL No:
Product Description
Catalog Number:
AG004KJY
Chemical Name:
Carbamic acid, [2-(4-bromophenyl)-1-hydroxy-2-oxoethyl]-, methyl ester
CAS Number:
88073-11-4
Molecular Formula:
C10H10BrNO4
Molecular Weight:
288.0947
IUPAC Name:
methyl N-[2-(4-bromophenyl)-1-hydroxy-2-oxoethyl]carbamate
InChI:
InChI=1S/C10H10BrNO4/c1-16-10(15)12-9(14)8(13)6-2-4-7(11)5-3-6/h2-5,9,14H,1H3,(H,12,15)
InChI Key:
WYOVVKDMKCONRZ-UHFFFAOYSA-N
SMILES:
COC(=O)NC(C(=O)c1ccc(cc1)Br)O
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.979g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.097g/mol
Monoisotopic Mass:
286.979g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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