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116477-41-9 | L-Serine, N-(bromoacetyl)- (9CI)
CAS No: 116477-41-9 Catalog No: AG000CLH MDL No:
Product Description
Catalog Number:
AG000CLH
Chemical Name:
L-Serine, N-(bromoacetyl)- (9CI)
CAS Number:
116477-41-9
Molecular Formula:
C5H8BrNO4
Molecular Weight:
226.0253
IUPAC Name:
2-[(2-bromoacetyl)amino]-3-hydroxypropanoic acid
InChI:
InChI=1S/C5H8BrNO4/c6-1-4(9)7-3(2-8)5(10)11/h3,8H,1-2H2,(H,7,9)(H,10,11)
InChI Key:
IFDHRWMOJCYNLG-UHFFFAOYSA-N
SMILES:
OC[C@@H](C(=O)O)NC(=O)CBr
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.964g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
226.026g/mol
Monoisotopic Mass:
224.964g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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