AH18258
71176-54-0 | 5-Amino-1,3-dihydroxymethylbenzene
Manufacturer: A2B Chem
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CatalogNumber
AH18258
ChemicalName
5-Amino-1,3-dihydroxymethylbenzene
CasNumber
71176-54-0
MolecularFormula
C8H11NO2
MolecularWeight
153.17844
MdlNumber
MFCD08690090
Smiles
OCc1cc(CO)cc(c1)N
Complexity
107
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
2
Xlogp3
-0.5
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CatalogNumber: AH18258
ChemicalName: 5-Amino-1,3-dihydroxymethylbenzene
CasNumber: 71176-54-0
MolecularFormula: C8H11NO2
MolecularWeight: 153.17844
MdlNumber: MFCD08690090
Smiles: OCc1cc(CO)cc(c1)N
Complexity: 107
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: -0.5
CatalogNumber:
AH18258
ChemicalName:
5-Amino-1,3-dihydroxymethylbenzene
CasNumber:
71176-54-0
MolecularFormula:
C8H11NO2
MolecularWeight:
153.17844
MdlNumber:
MFCD08690090
Smiles:
OCc1cc(CO)cc(c1)N
Complexity:
107
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1c(C)ccc2c1[nH]nc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
[O-][N+](=O)c1c(C)ccc2c1[nH]nc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1c(N)cccc1C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1c(N)cccc1C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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Smiles: CC1=C(C(=C(C=C1)O)[N+](=O)[O-])[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1=C(C(=C(C=C1)O)[N+](=O)[O-])[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__