Home Other Building Blocks ETHYL 6,7,8,9-TETRAHYDRO-5H-IMIDAZO[1,5-A][1,4]DIAZEPINE-1-CARBOXYLATE HCL

ETHYL 6,7,8,9-TETRAHYDRO-5H-IMIDAZO[1,5-A][1,4]DIAZEPINE-1-CARBOXYLATE HCL

CAS No.:
1422344-22-6
Catalog Number:
AG01DLEQ
Molecular Formula:
C10H16ClN3O2
Molecular Weight:
245.7059
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Product Description
Catalog Number:
AG01DLEQ
Chemical Name:
ETHYL 6,7,8,9-TETRAHYDRO-5H-IMIDAZO[1,5-A][1,4]DIAZEPINE-1-CARBOXYLATE HCL
CAS Number:
1422344-22-6
Molecular Formula:
C10H16ClN3O2
Molecular Weight:
245.7059
MDL Number:
MFCD23378337
IUPAC Name:
ethyl 6,7,8,9-tetrahydro-5H-imidazo[1,5-a][1,4]diazepine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C10H15N3O2.ClH/c1-2-15-10(14)9-8-6-11-4-3-5-13(8)7-12-9;/h7,11H,2-6H2,1H3;1H
InChI Key:
NXPWQODPJRCBMM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ncn2c1CNCCC2.Cl
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.093g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.707g/mol
Monoisotopic Mass:
245.093g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties