AB66904
1187385-69-8 | 4-Bromo-3,5-dimethyl-1-(tetrahydropyran-2-yl)pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AB66904
ChemicalName
4-Bromo-3,5-dimethyl-1-(tetrahydropyran-2-yl)pyrazole
CasNumber
1187385-69-8
MolecularFormula
C10H15BrN2O
MolecularWeight
259.1429
MdlNumber
MFCD11844792
Smiles
Cc1nn(c(c1Br)C)C1CCCCO1
Complexity
203
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AB66904
ChemicalName: 4-Bromo-3,5-dimethyl-1-(tetrahydropyran-2-yl)pyrazole
CasNumber: 1187385-69-8
MolecularFormula: C10H15BrN2O
MolecularWeight: 259.1429
MdlNumber: MFCD11844792
Smiles: Cc1nn(c(c1Br)C)C1CCCCO1
Complexity: 203
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AB66904
ChemicalName:
4-Bromo-3,5-dimethyl-1-(tetrahydropyran-2-yl)pyrazole
CasNumber:
1187385-69-8
MolecularFormula:
C10H15BrN2O
MolecularWeight:
259.1429
MdlNumber:
MFCD11844792
Smiles:
Cc1nn(c(c1Br)C)C1CCCCO1
Complexity:
203
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: AB66905
ChemicalName: 4-Bromo-3,5-dimethylbenzonitrile
CasNumber: 75344-77-3
MolecularFormula: C9H8BrN
MolecularWeight: 210.0705
MdlNumber: MFCD07369910
Smiles: N#Cc1cc(C)c(c(c1)C)Br
Complexity: 169
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 3.1
CatalogNumber:
AB66905
ChemicalName:
4-Bromo-3,5-dimethylbenzonitrile
CasNumber:
75344-77-3
MolecularFormula:
C9H8BrN
MolecularWeight:
210.0705
MdlNumber:
MFCD07369910
Smiles:
N#Cc1cc(C)c(c(c1)C)Br
Complexity:
169
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
3.1
CatalogNumber: AB66906
ChemicalName: 4-Bromo-3,5-dimethylisoxazole
CasNumber: 10558-25-5
MolecularFormula: C5H6BrNO
MolecularWeight: 176.0112
MdlNumber: MFCD00068187
Smiles: Brc1c(C)noc1C
Complexity: 88.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.9
CatalogNumber:
AB66906
ChemicalName:
4-Bromo-3,5-dimethylisoxazole
CasNumber:
10558-25-5
MolecularFormula:
C5H6BrNO
MolecularWeight:
176.0112
MdlNumber:
MFCD00068187
Smiles:
Brc1c(C)noc1C
Complexity:
88.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.9
CatalogNumber: AB66907
ChemicalName: 4-Bromo-3,5-dimethylphenol
CasNumber: 7463-51-6
MolecularFormula: C8H9BrO
MolecularWeight: 201.0605
MdlNumber: MFCD00002315
Smiles: Oc1cc(C)c(c(c1)C)Br
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 2
CatalogNumber:
AB66907
ChemicalName:
4-Bromo-3,5-dimethylphenol
CasNumber:
7463-51-6
MolecularFormula:
C8H9BrO
MolecularWeight:
201.0605
MdlNumber:
MFCD00002315
Smiles:
Oc1cc(C)c(c(c1)C)Br
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
2