AA02708
1005209-42-6 | Ethyl 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA02708
ChemicalName
Ethyl 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxylate
CasNumber
1005209-42-6
MolecularFormula
C9H8BrN3O2
MolecularWeight
270.0827
MdlNumber
MFCD11616111
Smiles
CCOC(=O)c1cc2n(n1)cc(cn2)Br
Complexity
252
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.6
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CatalogNumber: AA02708
ChemicalName: Ethyl 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxylate
CasNumber: 1005209-42-6
MolecularFormula: C9H8BrN3O2
MolecularWeight: 270.0827
MdlNumber: MFCD11616111
Smiles: CCOC(=O)c1cc2n(n1)cc(cn2)Br
Complexity: 252
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.6
CatalogNumber:
AA02708
ChemicalName:
Ethyl 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxylate
CasNumber:
1005209-42-6
MolecularFormula:
C9H8BrN3O2
MolecularWeight:
270.0827
MdlNumber:
MFCD11616111
Smiles:
CCOC(=O)c1cc2n(n1)cc(cn2)Br
Complexity:
252
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cc2n(n1)cc(cn2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cc2n(n1)cc(cn2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA02710
ChemicalName: 4-Benzylthiophenylboronic acid
CasNumber: 1005207-32-8
MolecularFormula: C13H13BO2S
MolecularWeight: 244.11712000000003
MdlNumber: MFCD06801692
Smiles: OB(c1ccc(cc1)SCc1ccccc1)O
Complexity: 212
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AA02710
ChemicalName:
4-Benzylthiophenylboronic acid
CasNumber:
1005207-32-8
MolecularFormula:
C13H13BO2S
MolecularWeight:
244.11712000000003
MdlNumber:
MFCD06801692
Smiles:
OB(c1ccc(cc1)SCc1ccccc1)O
Complexity:
212
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: AA02711
ChemicalName: 4-trifluoromethylthiophenylboronic acid pinacol ester
CasNumber: 1005206-25-6
MolecularFormula: C13H16BF3O2S
MolecularWeight: 304.1361
MdlNumber: MFCD11042448
Smiles: FC(Sc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 6
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AA02711
ChemicalName:
4-trifluoromethylthiophenylboronic acid pinacol ester
CasNumber:
1005206-25-6
MolecularFormula:
C13H16BF3O2S
MolecularWeight:
304.1361
MdlNumber:
MFCD11042448
Smiles:
FC(Sc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
6
RotatableBondCount:
2
Xlogp3:
__