AB19726
2100-31-4 | 2-Propoxybenzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB19726
ChemicalName
2-Propoxybenzoic acid
CasNumber
2100-31-4
MolecularFormula
C10H12O3
MolecularWeight
180.2005
MdlNumber
MFCD01075687
Smiles
CCCOc1ccccc1C(=O)O
Complexity
168
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.5
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CatalogNumber: AB19726
ChemicalName: 2-Propoxybenzoic acid
CasNumber: 2100-31-4
MolecularFormula: C10H12O3
MolecularWeight: 180.2005
MdlNumber: MFCD01075687
Smiles: CCCOc1ccccc1C(=O)O
Complexity: 168
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.5
CatalogNumber:
AB19726
ChemicalName:
2-Propoxybenzoic acid
CasNumber:
2100-31-4
MolecularFormula:
C10H12O3
MolecularWeight:
180.2005
MdlNumber:
MFCD01075687
Smiles:
CCCOc1ccccc1C(=O)O
Complexity:
168
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.5
CatalogNumber: AB19728
ChemicalName: 3-Iodo-1,2,4,5-tetramethylbenzene
CasNumber: 2100-25-6
MolecularFormula: C10H13I
MolecularWeight: 260.1147
MdlNumber: MFCD00013705
Smiles: Cc1cc(C)c(c(c1C)I)C
Complexity: 119
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 4.8
CatalogNumber:
AB19728
ChemicalName:
3-Iodo-1,2,4,5-tetramethylbenzene
CasNumber:
2100-25-6
MolecularFormula:
C10H13I
MolecularWeight:
260.1147
MdlNumber:
MFCD00013705
Smiles:
Cc1cc(C)c(c(c1C)I)C
Complexity:
119
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
4.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1cc(I)c(cc1C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1cc(I)c(cc1C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(c1cc(C(C)C)c(c(c1)C(C)C)I)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(c1cc(C(C)C)c(c(c1)C(C)C)I)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__