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1249103-94-3 | 2-Morpholinecarboxylic acid, 4-(2-pyrimidinyl)-
CAS No: 1249103-94-3 Catalog No: AG000MVH MDL No:
Product Description
Catalog Number:
AG000MVH
Chemical Name:
2-Morpholinecarboxylic acid, 4-(2-pyrimidinyl)-
CAS Number:
1249103-94-3
Molecular Formula:
C9H11N3O3
Molecular Weight:
209.2019
IUPAC Name:
4-pyrimidin-2-ylmorpholine-2-carboxylic acid
InChI:
InChI=1S/C9H11N3O3/c13-8(14)7-6-12(4-5-15-7)9-10-2-1-3-11-9/h1-3,7H,4-6H2,(H,13,14)
InChI Key:
JCWSNMPZSLAJRP-UHFFFAOYSA-N
SMILES:
OC(=O)C1OCCN(C1)c1ncccn1
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.205g/mol
Monoisotopic Mass:
209.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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