Home Nitriles 5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonitrile hydrochloride

5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonitrile hydrochloride

CAS No.:
1268983-06-7
Catalog Number:
AG00J25G
Molecular Formula:
C8H11ClN4
Molecular Weight:
198.6527
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
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Product Description
Catalog Number:
AG00J25G
Chemical Name:
5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonitrile hydrochloride
CAS Number:
1268983-06-7
Molecular Formula:
C8H11ClN4
Molecular Weight:
198.6527
MDL Number:
MFCD18483526
IUPAC Name:
5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonitrile;hydrochloride
InChI:
InChI=1S/C8H10N4.ClH/c9-5-7-4-8-6-10-2-1-3-12(8)11-7;/h4,10H,1-3,6H2;1H
InChI Key:
JGJHBXBQJIUNBY-UHFFFAOYSA-N
SMILES:
N#Cc1nn2c(c1)CNCCC2.Cl
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.067g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.654g/mol
Monoisotopic Mass:
198.067g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties