AE22635
104681-92-7 | 4,4-Dimethoxytetrahydro-2H-pyran-3-ol
Manufacturer: A2B Chem
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CatalogNumber
AE22635
ChemicalName
4,4-Dimethoxytetrahydro-2H-pyran-3-ol
CasNumber
104681-92-7
MolecularFormula
C7H14O4
MolecularWeight
162.18365999999997
MdlNumber
MFCD22648283
Smiles
COC1(OC)CCOCC1O
Complexity
122
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.7
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CatalogNumber: AE22635
ChemicalName: 4,4-Dimethoxytetrahydro-2H-pyran-3-ol
CasNumber: 104681-92-7
MolecularFormula: C7H14O4
MolecularWeight: 162.18365999999997
MdlNumber: MFCD22648283
Smiles: COC1(OC)CCOCC1O
Complexity: 122
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.7
CatalogNumber:
AE22635
ChemicalName:
4,4-Dimethoxytetrahydro-2H-pyran-3-ol
CasNumber:
104681-92-7
MolecularFormula:
C7H14O4
MolecularWeight:
162.18365999999997
MdlNumber:
MFCD22648283
Smiles:
COC1(OC)CCOCC1O
Complexity:
122
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.7
CatalogNumber: AE22637
ChemicalName: 4-Bromo-2-chloro-5-fluorobenzonitrile
CasNumber: 1126779-33-6
MolecularFormula: C7H2BrClFN
MolecularWeight: 234.4529
MdlNumber: MFCD11036199
Smiles: N#Cc1cc(F)c(cc1Cl)Br
Complexity: 190
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 3.1
CatalogNumber:
AE22637
ChemicalName:
4-Bromo-2-chloro-5-fluorobenzonitrile
CasNumber:
1126779-33-6
MolecularFormula:
C7H2BrClFN
MolecularWeight:
234.4529
MdlNumber:
MFCD11036199
Smiles:
N#Cc1cc(F)c(cc1Cl)Br
Complexity:
190
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.1
CatalogNumber: AE22638
ChemicalName: Imidazo[1,2-a]pyridin-2-ol
CasNumber: 112566-20-8
MolecularFormula: C7H6N2O
MolecularWeight: 134.1353
MdlNumber: MFCD09994219
Smiles: Oc1nc2n(c1)cccc2
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.7
CatalogNumber:
AE22638
ChemicalName:
Imidazo[1,2-a]pyridin-2-ol
CasNumber:
112566-20-8
MolecularFormula:
C7H6N2O
MolecularWeight:
134.1353
MdlNumber:
MFCD09994219
Smiles:
Oc1nc2n(c1)cccc2
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@H]1CC[C@@H](C1)C(=O)O.OC(=O)[C@@H]1CC[C@H](C1)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@H]1CC[C@@H](C1)C(=O)O.OC(=O)[C@@H]1CC[C@H](C1)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__