AB64925
77123-56-9 | 3-Ethynylbenzaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB64925
ChemicalName
3-Ethynylbenzaldehyde
CasNumber
77123-56-9
MolecularFormula
C9H6O
MolecularWeight
130.1433
MdlNumber
MFCD06245349
Smiles
O=Cc1cccc(c1)C#C
Complexity
163
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AB64925
ChemicalName: 3-Ethynylbenzaldehyde
CasNumber: 77123-56-9
MolecularFormula: C9H6O
MolecularWeight: 130.1433
MdlNumber: MFCD06245349
Smiles: O=Cc1cccc(c1)C#C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AB64925
ChemicalName:
3-Ethynylbenzaldehyde
CasNumber:
77123-56-9
MolecularFormula:
C9H6O
MolecularWeight:
130.1433
MdlNumber:
MFCD06245349
Smiles:
O=Cc1cccc(c1)C#C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#Cc1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB64927
ChemicalName: 3-Hydroxyphenylacetylene
CasNumber: 10401-11-3
MolecularFormula: C8H6O
MolecularWeight: 118.13264000000001
MdlNumber: MFCD00078347
Smiles: C#Cc1cccc(c1)O
Complexity: 131
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AB64927
ChemicalName:
3-Hydroxyphenylacetylene
CasNumber:
10401-11-3
MolecularFormula:
C8H6O
MolecularWeight:
118.13264000000001
MdlNumber:
MFCD00078347
Smiles:
C#Cc1cccc(c1)O
Complexity:
131
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#Cc1cscc1
Complexity: 98
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#Cc1cscc1
Complexity:
98
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8