AA28550
1245563-11-4 | 1-Bromo-3-(cyclopropylmethoxy)-5-methylbenzene
Manufacturer: A2B Chem
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CatalogNumber
AA28550
ChemicalName
1-Bromo-3-(cyclopropylmethoxy)-5-methylbenzene
CasNumber
1245563-11-4
MolecularFormula
C11H13BrO
MolecularWeight
241.1243
MdlNumber
MFCD17015803
Smiles
Cc1cc(OCC2CC2)cc(c1)Br
Complexity
168
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
1
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AA28550
ChemicalName: 1-Bromo-3-(cyclopropylmethoxy)-5-methylbenzene
CasNumber: 1245563-11-4
MolecularFormula: C11H13BrO
MolecularWeight: 241.1243
MdlNumber: MFCD17015803
Smiles: Cc1cc(OCC2CC2)cc(c1)Br
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AA28550
ChemicalName:
1-Bromo-3-(cyclopropylmethoxy)-5-methylbenzene
CasNumber:
1245563-11-4
MolecularFormula:
C11H13BrO
MolecularWeight:
241.1243
MdlNumber:
MFCD17015803
Smiles:
Cc1cc(OCC2CC2)cc(c1)Br
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
RotatableBondCount:
3
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNC(=O)c1ccc(cc1OCC)Br
Complexity: 211
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNC(=O)c1ccc(cc1OCC)Br
Complexity:
211
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2.5
CatalogNumber: AA28552
ChemicalName: Dimethyl 2-(5-bromo-3-nitropyridin-2-yl)malonate
CasNumber: 1245563-09-0
MolecularFormula: C10H9BrN2O6
MolecularWeight: 333.0923
MdlNumber: MFCD17015848
Smiles: COC(=O)C(c1ncc(cc1[N+](=O)[O-])Br)C(=O)OC
Complexity: 356
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 7
RotatableBondCount: 5
Xlogp3: 1.3
CatalogNumber:
AA28552
ChemicalName:
Dimethyl 2-(5-bromo-3-nitropyridin-2-yl)malonate
CasNumber:
1245563-09-0
MolecularFormula:
C10H9BrN2O6
MolecularWeight:
333.0923
MdlNumber:
MFCD17015848
Smiles:
COC(=O)C(c1ncc(cc1[N+](=O)[O-])Br)C(=O)OC
Complexity:
356
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
7
RotatableBondCount:
5
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(CNc1ncc(cn1)Br)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(CNc1ncc(cn1)Br)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__