AB54408
624-95-3 | 3,3-Dimethylbutan-1-ol
Manufacturer: A2B Chem
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CatalogNumber
AB54408
ChemicalName
3,3-Dimethylbutan-1-ol
CasNumber
624-95-3
MolecularFormula
C6H14O
MolecularWeight
102.1748
MdlNumber
MFCD10700131
Smiles
OCCC(C)(C)C
NscNumber
54158
Complexity
42.6
Covalently-bondedUnitCount
1
HeavyAtomCount
7
HydrogenBondAcceptorCount
1
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.6
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CatalogNumber: AB54408
ChemicalName: 3,3-Dimethylbutan-1-ol
CasNumber: 624-95-3
MolecularFormula: C6H14O
MolecularWeight: 102.1748
MdlNumber: MFCD10700131
Smiles: OCCC(C)(C)C
NscNumber: 54158
Complexity: 42.6
Covalently-bondedUnitCount: 1
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.6
CatalogNumber:
AB54408
ChemicalName:
3,3-Dimethylbutan-1-ol
CasNumber:
624-95-3
MolecularFormula:
C6H14O
MolecularWeight:
102.1748
MdlNumber:
MFCD10700131
Smiles:
OCCC(C)(C)C
NscNumber:
54158
Complexity:
42.6
Covalently-bondedUnitCount:
1
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.6
CatalogNumber: AB54409
ChemicalName: 3,3'-Diaminodiphenyl sulfone
CasNumber: 599-61-1
MolecularFormula: C12H12N2O2S
MolecularWeight: 248.30088
MdlNumber: MFCD00007792
Smiles: Nc1cccc(c1)S(=O)(=O)c1cccc(c1)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB54409
ChemicalName:
3,3'-Diaminodiphenyl sulfone
CasNumber:
599-61-1
MolecularFormula:
C12H12N2O2S
MolecularWeight:
248.30088
MdlNumber:
MFCD00007792
Smiles:
Nc1cccc(c1)S(=O)(=O)c1cccc(c1)N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB54410
ChemicalName: 3,4-(Methylenedioxy)cinnamic acid
CasNumber: 2373-80-0
MolecularFormula: C10H8O4
MolecularWeight: 192.16812
MdlNumber: MFCD00005837
Smiles: OC(=O)C=Cc1ccc2c(c1)OCO2
NscNumber: __
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.1
CatalogNumber:
AB54410
ChemicalName:
3,4-(Methylenedioxy)cinnamic acid
CasNumber:
2373-80-0
MolecularFormula:
C10H8O4
MolecularWeight:
192.16812
MdlNumber:
MFCD00005837
Smiles:
OC(=O)C=Cc1ccc2c(c1)OCO2
NscNumber:
__
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)c1ccc2c(c1)OCO2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)c1ccc2c(c1)OCO2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__