AH98041
877064-95-4 | (3-Bromo-4-methyl-phenyl)-methyl-carbamic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AH98041
ChemicalName
(3-Bromo-4-methyl-phenyl)-methyl-carbamic acid tert-butyl ester
CasNumber
877064-95-4
MolecularFormula
C13H18BrNO2
MolecularWeight
300.1915
MdlNumber
MFCD12913705
Smiles
O=C(N(c1ccc(c(c1)Br)C)C)OC(C)(C)C
Complexity
275
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
3.7
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CatalogNumber: AH98041
ChemicalName: (3-Bromo-4-methyl-phenyl)-methyl-carbamic acid tert-butyl ester
CasNumber: 877064-95-4
MolecularFormula: C13H18BrNO2
MolecularWeight: 300.1915
MdlNumber: MFCD12913705
Smiles: O=C(N(c1ccc(c(c1)Br)C)C)OC(C)(C)C
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 3.7
CatalogNumber:
AH98041
ChemicalName:
(3-Bromo-4-methyl-phenyl)-methyl-carbamic acid tert-butyl ester
CasNumber:
877064-95-4
MolecularFormula:
C13H18BrNO2
MolecularWeight:
300.1915
MdlNumber:
MFCD12913705
Smiles:
O=C(N(c1ccc(c(c1)Br)C)C)OC(C)(C)C
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
3.7
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Smiles: CCc1cc(Br)ccc1CO
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCc1cc(Br)ccc1CO
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Smiles: COC(=O)c1c(C)cc(cc1OC)Br
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Smiles:
COC(=O)c1c(C)cc(cc1OC)Br
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__
HydrogenBondAcceptorCount:
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Smiles: ClCCn1ncc(c1)B1OC(C(O1)(C)C)(C)C
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
ClCCn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__