AB65537
645-45-4 | 3-Phenylpropionyl chloride, tech grade
Manufacturer: A2B Chem
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CatalogNumber
AB65537
ChemicalName
3-Phenylpropionyl chloride, tech grade
CasNumber
645-45-4
MolecularFormula
C9H9ClO
MolecularWeight
168.62016000000003
MdlNumber
MFCD00000748
Smiles
ClC(=O)CCc1ccccc1
NscNumber
2854
Complexity
128
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
1
RotatableBondCount
3
Xlogp3
2.8
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CatalogNumber: AB65537
ChemicalName: 3-Phenylpropionyl chloride, tech grade
CasNumber: 645-45-4
MolecularFormula: C9H9ClO
MolecularWeight: 168.62016000000003
MdlNumber: MFCD00000748
Smiles: ClC(=O)CCc1ccccc1
NscNumber: 2854
Complexity: 128
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB65537
ChemicalName:
3-Phenylpropionyl chloride, tech grade
CasNumber:
645-45-4
MolecularFormula:
C9H9ClO
MolecularWeight:
168.62016000000003
MdlNumber:
MFCD00000748
Smiles:
ClC(=O)CCc1ccccc1
NscNumber:
2854
Complexity:
128
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AB65538
ChemicalName: Methyl 3-phenylpropionate
CasNumber: 103-25-3
MolecularFormula: C10H12O2
MolecularWeight: 164.20108000000002
MdlNumber: MFCD00017209
Smiles: COC(=O)CCc1ccccc1
NscNumber: __
Complexity: 137
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
RotatableBondCount: 4
Xlogp3: 2.3
CatalogNumber:
AB65538
ChemicalName:
Methyl 3-phenylpropionate
CasNumber:
103-25-3
MolecularFormula:
C10H12O2
MolecularWeight:
164.20108000000002
MdlNumber:
MFCD00017209
Smiles:
COC(=O)CCc1ccccc1
NscNumber:
__
Complexity:
137
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
RotatableBondCount:
4
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CCCc1ccccc1
NscNumber: __
Complexity: 125
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CCCc1ccccc1
NscNumber:
__
Complexity:
125
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(C)C)OCCCc1ccccc1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(C)C)OCCCc1ccccc1
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__