AA14963
116118-99-1 | 4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AA14963
ChemicalName
4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid hydrochloride
CasNumber
116118-99-1
MolecularFormula
C8H10ClNO2S
MolecularWeight
219.6885
MdlNumber
MFCD20489124
Smiles
OC(=O)c1cc2c(s1)CCNC2.Cl
Complexity
198
Covalently-bondedUnitCount
2
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
1
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CatalogNumber: AA14963
ChemicalName: 4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid hydrochloride
CasNumber: 116118-99-1
MolecularFormula: C8H10ClNO2S
MolecularWeight: 219.6885
MdlNumber: MFCD20489124
Smiles: OC(=O)c1cc2c(s1)CCNC2.Cl
Complexity: 198
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 1
CatalogNumber:
AA14963
ChemicalName:
4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid hydrochloride
CasNumber:
116118-99-1
MolecularFormula:
C8H10ClNO2S
MolecularWeight:
219.6885
MdlNumber:
MFCD20489124
Smiles:
OC(=O)c1cc2c(s1)CCNC2.Cl
Complexity:
198
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCOc2c1cc(cc2)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CCOc2c1cc(cc2)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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CatalogNumber: AA14966
ChemicalName: 3-Bromo-5-(trifluoromethyl)phenylacetic acid
CasNumber: 1161362-01-1
MolecularFormula: C9H6BrF3O2
MolecularWeight: 283.0419
MdlNumber: MFCD13194218
Smiles: OC(=O)Cc1cc(Br)cc(c1)C(F)(F)F
Complexity: 242
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 2
CatalogNumber:
AA14966
ChemicalName:
3-Bromo-5-(trifluoromethyl)phenylacetic acid
CasNumber:
1161362-01-1
MolecularFormula:
C9H6BrF3O2
MolecularWeight:
283.0419
MdlNumber:
MFCD13194218
Smiles:
OC(=O)Cc1cc(Br)cc(c1)C(F)(F)F
Complexity:
242
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccccc1c1cc(=O)[nH]c(=O)[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccccc1c1cc(=O)[nH]c(=O)[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__