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173850-78-7 | 1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine hydrochloride
CAS No: 173850-78-7 Catalog No: AG019LEQ MDL No:MFCD09971373
Product Description
Catalog Number:
AG019LEQ
Chemical Name:
1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine hydrochloride
CAS Number:
173850-78-7
Molecular Formula:
C9H16ClN3O
Molecular Weight:
217.6958
MDL Number:
MFCD09971373
IUPAC Name:
5-methyl-3-(piperazin-1-ylmethyl)-1,2-oxazole;hydrochloride
InChI:
InChI=1S/C9H15N3O.ClH/c1-8-6-9(11-13-8)7-12-4-2-10-3-5-12;/h6,10H,2-5,7H2,1H3;1H
InChI Key:
PWIOGFLREIMRFM-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)CN1CCNCC1.Cl
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.697g/mol
Monoisotopic Mass:
217.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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