AE48049
113081-50-8 | 2-(4-Bromo-3-methoxyphenyl)acetonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE48049
ChemicalName
2-(4-Bromo-3-methoxyphenyl)acetonitrile
CasNumber
113081-50-8
MolecularFormula
C9H8BrNO
MolecularWeight
226.0699
MdlNumber
MFCD06797367
Smiles
N#CCc1ccc(c(c1)OC)Br
Complexity
186
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
RotatableBondCount
2
Xlogp3
1.9
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CatalogNumber: AE48049
ChemicalName: 2-(4-Bromo-3-methoxyphenyl)acetonitrile
CasNumber: 113081-50-8
MolecularFormula: C9H8BrNO
MolecularWeight: 226.0699
MdlNumber: MFCD06797367
Smiles: N#CCc1ccc(c(c1)OC)Br
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AE48049
ChemicalName:
2-(4-Bromo-3-methoxyphenyl)acetonitrile
CasNumber:
113081-50-8
MolecularFormula:
C9H8BrNO
MolecularWeight:
226.0699
MdlNumber:
MFCD06797367
Smiles:
N#CCc1ccc(c(c1)OC)Br
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
2
Xlogp3:
1.9
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Smiles: CN1CCN(CC1)c1ccc(cc1Br)C(=O)O
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HydrogenBondAcceptorCount: __
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Smiles:
CN1CCN(CC1)c1ccc(cc1Br)C(=O)O
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Smiles: CSc1nc(SC)c2n(n1)c(Br)cn2
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Smiles:
CSc1nc(SC)c2n(n1)c(Br)cn2
Complexity:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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Smiles: C1=CC=C(C=C1)COC2=CC=CNC2=S
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HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
C1=CC=C(C=C1)COC2=CC=CNC2=S
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__