AA65312
14703-69-6 | 3-(Methylamino)phenol
Manufacturer: A2B Chem
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CatalogNumber
AA65312
ChemicalName
3-(Methylamino)phenol
CasNumber
14703-69-6
MolecularFormula
C7H9NO
MolecularWeight
123.1525
MdlNumber
MFCD16998628
Smiles
CNc1cccc(c1)O
Complexity
85
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AA65312
ChemicalName: 3-(Methylamino)phenol
CasNumber: 14703-69-6
MolecularFormula: C7H9NO
MolecularWeight: 123.1525
MdlNumber: MFCD16998628
Smiles: CNc1cccc(c1)O
Complexity: 85
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AA65312
ChemicalName:
3-(Methylamino)phenol
CasNumber:
14703-69-6
MolecularFormula:
C7H9NO
MolecularWeight:
123.1525
MdlNumber:
MFCD16998628
Smiles:
CNc1cccc(c1)O
Complexity:
85
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AA65313
ChemicalName: Brettphos Pd(II) G3
CasNumber: 1470372-59-8
MolecularFormula: C48H67NO5PPdS
MolecularWeight: 907.508
MdlNumber: MFCD22572666
Smiles: COc1ccc(c(c1P([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C1CCCCC1)C1CCCCC1)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity: 1090
Covalently-bondedUnitCount: 4
HeavyAtomCount: 57
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: __
CatalogNumber:
AA65313
ChemicalName:
Brettphos Pd(II) G3
CasNumber:
1470372-59-8
MolecularFormula:
C48H67NO5PPdS
MolecularWeight:
907.508
MdlNumber:
MFCD22572666
Smiles:
COc1ccc(c(c1P([Pd+2]1([NH2]c2ccccc2C2=[C-]1C=CC=C2)[O-]S(=O)(=O)C)(C1CCCCC1)C1CCCCC1)c1c(cc(cc1C(C)C)C(C)C)C(C)C)OC
Complexity:
1090
Covalently-bondedUnitCount:
4
HeavyAtomCount:
57
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC(=O)c1cc(n(c1C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)c1cc(n(c1C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1nc(N)c2c(n1)n(cn2)C[C@H](OCP(=O)(O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Nc1nc(N)c2c(n1)n(cn2)C[C@H](OCP(=O)(O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__