AF87302
34674-75-4 | Methyl 3-amino-5-nitro-1-benzothiophene-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF87302
ChemicalName
Methyl 3-amino-5-nitro-1-benzothiophene-2-carboxylate
CasNumber
34674-75-4
MolecularFormula
C10H8N2O4S
MolecularWeight
252.2465
MdlNumber
MFCD00245562
Smiles
COC(=O)c1sc2c(c1N)cc(cc2)[N+](=O)[O-]
Complexity
333
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AF87302
ChemicalName: Methyl 3-amino-5-nitro-1-benzothiophene-2-carboxylate
CasNumber: 34674-75-4
MolecularFormula: C10H8N2O4S
MolecularWeight: 252.2465
MdlNumber: MFCD00245562
Smiles: COC(=O)c1sc2c(c1N)cc(cc2)[N+](=O)[O-]
Complexity: 333
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AF87302
ChemicalName:
Methyl 3-amino-5-nitro-1-benzothiophene-2-carboxylate
CasNumber:
34674-75-4
MolecularFormula:
C10H8N2O4S
MolecularWeight:
252.2465
MdlNumber:
MFCD00245562
Smiles:
COC(=O)c1sc2c(c1N)cc(cc2)[N+](=O)[O-]
Complexity:
333
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AF87303
ChemicalName: 4,5,6,7-Tetrahydro-2H-indazol-3-ol
CasNumber: 402602-24-8
MolecularFormula: C7H10N2O
MolecularWeight: 138.1671
MdlNumber: MFCD00462221
Smiles: Oc1[nH]nc2c1CCCC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AF87303
ChemicalName:
4,5,6,7-Tetrahydro-2H-indazol-3-ol
CasNumber:
402602-24-8
MolecularFormula:
C7H10N2O
MolecularWeight:
138.1671
MdlNumber:
MFCD00462221
Smiles:
Oc1[nH]nc2c1CCCC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF87304
ChemicalName: 6-Chloro-N,N-dimethyl-3-pyridinamine
CasNumber: 41288-91-9
MolecularFormula: C7H9ClN2
MolecularWeight: 156.6128
MdlNumber: MFCD00234337
Smiles: Clc1ccc(cn1)N(C)C
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.9
CatalogNumber:
AF87304
ChemicalName:
6-Chloro-N,N-dimethyl-3-pyridinamine
CasNumber:
41288-91-9
MolecularFormula:
C7H9ClN2
MolecularWeight:
156.6128
MdlNumber:
MFCD00234337
Smiles:
Clc1ccc(cn1)N(C)C
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.9
CatalogNumber: AF87305
ChemicalName: 4-(tert-Butyl)-2-iodophenol
CasNumber: 38941-98-9
MolecularFormula: C10H13IO
MolecularWeight: 276.1141
MdlNumber: MFCD11035758
Smiles: Oc1ccc(cc1I)C(C)(C)C
Complexity: 150
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.9
CatalogNumber:
AF87305
ChemicalName:
4-(tert-Butyl)-2-iodophenol
CasNumber:
38941-98-9
MolecularFormula:
C10H13IO
MolecularWeight:
276.1141
MdlNumber:
MFCD11035758
Smiles:
Oc1ccc(cc1I)C(C)(C)C
Complexity:
150
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.9