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Home > Other Heterocycles > 1204346-31-5
1204346-31-5 | 6-methoxy-3,4-dihydrospiro[1,3-benzoxazine-2,4'-piperidine]-4-one hydrochloride
CAS No: 1204346-31-5 Catalog No: AG00ISOV MDL No:MFCD22372630
Product Description
Catalog Number:
AG00ISOV
Chemical Name:
6-methoxy-3,4-dihydrospiro[1,3-benzoxazine-2,4'-piperidine]-4-one hydrochloride
CAS Number:
1204346-31-5
Molecular Formula:
C13H17ClN2O3
Molecular Weight:
284.7387
MDL Number:
MFCD22372630
IUPAC Name:
6-methoxyspiro[3H-1,3-benzoxazine-2,4'-piperidine]-4-one;hydrochloride
InChI:
InChI=1S/C13H16N2O3.ClH/c1-17-9-2-3-11-10(8-9)12(16)15-13(18-11)4-6-14-7-5-13;/h2-3,8,14H,4-7H2,1H3,(H,15,16);1H
InChI Key:
PNMYEOHLKVBVJQ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(=O)NC1(O2)CCNCC1.Cl
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.093g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
284.74g/mol
Monoisotopic Mass:
284.093g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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