AB55143
6214-45-5 | 4-Butoxybenzyl alcohol
Manufacturer: A2B Chem
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CatalogNumber
AB55143
ChemicalName
4-Butoxybenzyl alcohol
CasNumber
6214-45-5
MolecularFormula
C11H16O2
MolecularWeight
180.2435
MdlNumber
MFCD00004657
Smiles
CCCCOc1ccc(cc1)CO
NscNumber
69089
Complexity
117
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
2.4
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CatalogNumber: AB55143
ChemicalName: 4-Butoxybenzyl alcohol
CasNumber: 6214-45-5
MolecularFormula: C11H16O2
MolecularWeight: 180.2435
MdlNumber: MFCD00004657
Smiles: CCCCOc1ccc(cc1)CO
NscNumber: 69089
Complexity: 117
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 2.4
CatalogNumber:
AB55143
ChemicalName:
4-Butoxybenzyl alcohol
CasNumber:
6214-45-5
MolecularFormula:
C11H16O2
MolecularWeight:
180.2435
MdlNumber:
MFCD00004657
Smiles:
CCCCOc1ccc(cc1)CO
NscNumber:
69089
Complexity:
117
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
2.4
CatalogNumber: AB55144
ChemicalName: 4-Butyrylphenylboronic acid
CasNumber: 186498-24-8
MolecularFormula: C10H13BO3
MolecularWeight: 192.0194
MdlNumber: MFCD08701778
Smiles: CCCC(=O)c1ccc(cc1)B(O)O
NscNumber: __
Complexity: 186
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: __
CatalogNumber:
AB55144
ChemicalName:
4-Butyrylphenylboronic acid
CasNumber:
186498-24-8
MolecularFormula:
C10H13BO3
MolecularWeight:
192.0194
MdlNumber:
MFCD08701778
Smiles:
CCCC(=O)c1ccc(cc1)B(O)O
NscNumber:
__
Complexity:
186
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)COc1ccc(cc1C)Cl
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)COc1ccc(cc1C)Cl
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cn1nc(c(c1C)Cl)[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cn1nc(c(c1C)Cl)[N+](=O)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__