AI51898
531-95-3 | (S)-3-(4-Hydroxyphenyl)chroman-7-ol
Manufacturer: A2B Chem
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CatalogNumber
AI51898
ChemicalName
(S)-3-(4-Hydroxyphenyl)chroman-7-ol
CasNumber
531-95-3
MolecularFormula
C15H14O3
MolecularWeight
242.2699
MdlNumber
MFCD00200962
Smiles
Oc1ccc(cc1)[C@H]1COc2c(C1)ccc(c2)O
Complexity
273
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AI51898
ChemicalName: (S)-3-(4-Hydroxyphenyl)chroman-7-ol
CasNumber: 531-95-3
MolecularFormula: C15H14O3
MolecularWeight: 242.2699
MdlNumber: MFCD00200962
Smiles: Oc1ccc(cc1)[C@H]1COc2c(C1)ccc(c2)O
Complexity: 273
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AI51898
ChemicalName:
(S)-3-(4-Hydroxyphenyl)chroman-7-ol
CasNumber:
531-95-3
MolecularFormula:
C15H14O3
MolecularWeight:
242.2699
MdlNumber:
MFCD00200962
Smiles:
Oc1ccc(cc1)[C@H]1COc2c(C1)ccc(c2)O
Complexity:
273
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCNC(=O)Nc1ccc(cc1)Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCNC(=O)Nc1ccc(cc1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(Nc1ccc(cc1)Cl)NCc1cccnc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(Nc1ccc(cc1)Cl)NCc1cccnc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(=O)Cc1cccc(c1)OC
Complexity: 170
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(=O)Cc1cccc(c1)OC
Complexity:
170
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.3