AC96796
68217-74-3 | 9-(2-Bromoethyl)-9H-purin-6-amine
Manufacturer: A2B Chem
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CatalogNumber
AC96796
ChemicalName
9-(2-Bromoethyl)-9H-purin-6-amine
CasNumber
68217-74-3
MolecularFormula
C7H8BrN5
MolecularWeight
242.07592
MdlNumber
MFCD00204182
Smiles
BrCCn1cnc2c1ncnc2N
Complexity
178
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.6
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CatalogNumber: AC96796
ChemicalName: 9-(2-Bromoethyl)-9H-purin-6-amine
CasNumber: 68217-74-3
MolecularFormula: C7H8BrN5
MolecularWeight: 242.07592
MdlNumber: MFCD00204182
Smiles: BrCCn1cnc2c1ncnc2N
Complexity: 178
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.6
CatalogNumber:
AC96796
ChemicalName:
9-(2-Bromoethyl)-9H-purin-6-amine
CasNumber:
68217-74-3
MolecularFormula:
C7H8BrN5
MolecularWeight:
242.07592
MdlNumber:
MFCD00204182
Smiles:
BrCCn1cnc2c1ncnc2N
Complexity:
178
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.6
CatalogNumber: AC96798
ChemicalName: 3-Bromo-2,5-dimethoxybenzaldehyde
CasNumber: 68216-65-9
MolecularFormula: C9H9BrO3
MolecularWeight: 245.07
MdlNumber: MFCD00091892
Smiles: COc1cc(C=O)c(c(c1)Br)OC
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AC96798
ChemicalName:
3-Bromo-2,5-dimethoxybenzaldehyde
CasNumber:
68216-65-9
MolecularFormula:
C9H9BrO3
MolecularWeight:
245.07
MdlNumber:
MFCD00091892
Smiles:
COc1cc(C=O)c(c(c1)Br)OC
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1cccnc1.CCCS(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
c1cccnc1.CCCS(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]S(=O)(=O)O.CCCCCCCCCCCCCCCC[N+](C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]S(=O)(=O)O.CCCCCCCCCCCCCCCC[N+](C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__