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Home > Aldehydes > 1860390-17-5
1860390-17-5 | 4-(3-hydroxyazetidin-1-yl)-2-methoxy-1,3-thiazole-5-carbaldehyde
CAS No: 1860390-17-5 Catalog No: AG01C8TZ MDL No:MFCD31443274
Product Description
Catalog Number:
AG01C8TZ
Chemical Name:
4-(3-hydroxyazetidin-1-yl)-2-methoxy-1,3-thiazole-5-carbaldehyde
CAS Number:
1860390-17-5
Molecular Formula:
C8H10N2O3S
Molecular Weight:
214.2416
MDL Number:
MFCD31443274
IUPAC Name:
4-(3-hydroxyazetidin-1-yl)-2-methoxy-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C8H10N2O3S/c1-13-8-9-7(6(4-11)14-8)10-2-5(12)3-10/h4-5,12H,2-3H2,1H3
InChI Key:
DKAWEBNOCAQVFF-UHFFFAOYSA-N
SMILES:
COc1nc(c(s1)C=O)N1CC(C1)O
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.041g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.239g/mol
Monoisotopic Mass:
214.041g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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