AD09494
89975-77-9 | [4-(Hydroxymethyl)oxan-4-yl]methanol
Manufacturer: A2B Chem
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CatalogNumber
AD09494
ChemicalName
[4-(Hydroxymethyl)oxan-4-yl]methanol
CasNumber
89975-77-9
MolecularFormula
C7H14O3
MolecularWeight
146.18426000000002
MdlNumber
MFCD16653124
Smiles
OCC1(CO)CCOCC1
Complexity
91
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
-0.7
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CatalogNumber: AD09494
ChemicalName: [4-(Hydroxymethyl)oxan-4-yl]methanol
CasNumber: 89975-77-9
MolecularFormula: C7H14O3
MolecularWeight: 146.18426000000002
MdlNumber: MFCD16653124
Smiles: OCC1(CO)CCOCC1
Complexity: 91
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: -0.7
CatalogNumber:
AD09494
ChemicalName:
[4-(Hydroxymethyl)oxan-4-yl]methanol
CasNumber:
89975-77-9
MolecularFormula:
C7H14O3
MolecularWeight:
146.18426000000002
MdlNumber:
MFCD16653124
Smiles:
OCC1(CO)CCOCC1
Complexity:
91
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=N)Nc1ccc(cc1)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=N)Nc1ccc(cc1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD09504
ChemicalName: 4-(Methoxymethyl)benzoic acid
CasNumber: 67003-50-3
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD06375934
Smiles: COCc1ccc(cc1)C(=O)O
Complexity: 148
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.5
CatalogNumber:
AD09504
ChemicalName:
4-(Methoxymethyl)benzoic acid
CasNumber:
67003-50-3
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD06375934
Smiles:
COCc1ccc(cc1)C(=O)O
Complexity:
148
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCC[C@@H](CC(=O)OC)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCC[C@@H](CC(=O)OC)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__