AE18669
105285-21-0 | 4-tert-Butyl-1H-pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AE18669
ChemicalName
4-tert-Butyl-1H-pyrazole
CasNumber
105285-21-0
MolecularFormula
C7H12N2
MolecularWeight
124.1836
MdlNumber
MFCD11847492
Smiles
CC(c1c[nH]nc1)(C)C
Complexity
93.6
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.7
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CatalogNumber: AE18669
ChemicalName: 4-tert-Butyl-1H-pyrazole
CasNumber: 105285-21-0
MolecularFormula: C7H12N2
MolecularWeight: 124.1836
MdlNumber: MFCD11847492
Smiles: CC(c1c[nH]nc1)(C)C
Complexity: 93.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.7
CatalogNumber:
AE18669
ChemicalName:
4-tert-Butyl-1H-pyrazole
CasNumber:
105285-21-0
MolecularFormula:
C7H12N2
MolecularWeight:
124.1836
MdlNumber:
MFCD11847492
Smiles:
CC(c1c[nH]nc1)(C)C
Complexity:
93.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)N=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CN(CCN1CCCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)N=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1cc(N)c(cc1C)Cl.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1cc(N)c(cc1C)Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE18674
ChemicalName: 6-Bromo-3-iodopyrazolo[1,5-a]pyrimidine
CasNumber: 1109284-33-4
MolecularFormula: C6H3BrIN3
MolecularWeight: 323.9166
MdlNumber: MFCD18073604
Smiles: Brc1cnc2n(c1)ncc2I
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
AE18674
ChemicalName:
6-Bromo-3-iodopyrazolo[1,5-a]pyrimidine
CasNumber:
1109284-33-4
MolecularFormula:
C6H3BrIN3
MolecularWeight:
323.9166
MdlNumber:
MFCD18073604
Smiles:
Brc1cnc2n(c1)ncc2I
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7