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1808623-84-8

1808623-84-8 | octahydro-1H-pyrido[4,3-d][1,3]oxazin-2-one hydrochloride, trans

CAS No: 1808623-84-8 Catalog No: AG01B7Q0 MDL No:MFCD28390193

Product Description

Catalog Number:
AG01B7Q0
Chemical Name:
octahydro-1H-pyrido[4,3-d][1,3]oxazin-2-one hydrochloride, trans
CAS Number:
1808623-84-8
Molecular Formula:
C7H13ClN2O2
Molecular Weight:
192.6433
MDL Number:
MFCD28390193
IUPAC Name:
(4aS,8aS)-1,4,4a,5,6,7,8,8a-octahydropyrido[4,3-d][1,3]oxazin-2-one;hydrochloride
InChI:
InChI=1S/C7H12N2O2.ClH/c10-7-9-6-1-2-8-3-5(6)4-11-7;/h5-6,8H,1-4H2,(H,9,10);1H/t5-,6+;/m1./s1
InChI Key:
STKFMIGDKIUMKE-IBTYICNHSA-N
SMILES:
O=C1OC[C@@H]2[C@@H](N1)CCNC2.Cl

Properties

Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
192.067g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
192.643g/mol
Monoisotopic Mass:
192.067g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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