AG19848
523977-64-2 | 4-Bromo-2-cyanobenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AG19848
ChemicalName
4-Bromo-2-cyanobenzaldehyde
CasNumber
523977-64-2
MolecularFormula
C8H4BrNO
MolecularWeight
210.0275
MdlNumber
MFCD09261030
Smiles
N#Cc1cc(Br)ccc1C=O
Complexity
196
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AG19848
ChemicalName: 4-Bromo-2-cyanobenzaldehyde
CasNumber: 523977-64-2
MolecularFormula: C8H4BrNO
MolecularWeight: 210.0275
MdlNumber: MFCD09261030
Smiles: N#Cc1cc(Br)ccc1C=O
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AG19848
ChemicalName:
4-Bromo-2-cyanobenzaldehyde
CasNumber:
523977-64-2
MolecularFormula:
C8H4BrNO
MolecularWeight:
210.0275
MdlNumber:
MFCD09261030
Smiles:
N#Cc1cc(Br)ccc1C=O
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc2c(c1)nc([nH]2)N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Oc1ccc2c(c1)nc([nH]2)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1cc(O)c2c(o1)cc(c(c2)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1cc(O)c2c(o1)cc(c(c2)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG19854
ChemicalName: 1-Methylbenzodiazole-5-carboxylic acid
CasNumber: 53484-17-6
MolecularFormula: C9H8N2O2
MolecularWeight: 176.172
MdlNumber: MFCD06809665
Smiles: OC(=O)c1ccc2c(c1)ncn2C
Complexity: 220
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AG19854
ChemicalName:
1-Methylbenzodiazole-5-carboxylic acid
CasNumber:
53484-17-6
MolecularFormula:
C9H8N2O2
MolecularWeight:
176.172
MdlNumber:
MFCD06809665
Smiles:
OC(=O)c1ccc2c(c1)ncn2C
Complexity:
220
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
RotatableBondCount:
1
Xlogp3:
1