AB50127
360056-45-7 | Methyl 4-amino-1H-pyrazole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB50127
ChemicalName
Methyl 4-amino-1H-pyrazole-3-carboxylate
CasNumber
360056-45-7
MolecularFormula
C5H7N3O2
MolecularWeight
141.128
MdlNumber
MFCD01311423
Smiles
COC(=O)c1c(N)cn[nH]1
Complexity
139
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.3
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CatalogNumber: AB50127
ChemicalName: Methyl 4-amino-1H-pyrazole-3-carboxylate
CasNumber: 360056-45-7
MolecularFormula: C5H7N3O2
MolecularWeight: 141.128
MdlNumber: MFCD01311423
Smiles: COC(=O)c1c(N)cn[nH]1
Complexity: 139
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.3
CatalogNumber:
AB50127
ChemicalName:
Methyl 4-amino-1H-pyrazole-3-carboxylate
CasNumber:
360056-45-7
MolecularFormula:
C5H7N3O2
MolecularWeight:
141.128
MdlNumber:
MFCD01311423
Smiles:
COC(=O)c1c(N)cn[nH]1
Complexity:
139
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cccc(c1)Br
Complexity: 64.9
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cccc(c1)Br
Complexity:
64.9
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.8
CatalogNumber: AB50130
ChemicalName: (2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid
CasNumber: 336818-78-1
MolecularFormula: C16H21NO4
MolecularWeight: 291.3422
MdlNumber: MFCD06656435
Smiles: O=C(N1C[C@H](C[C@H]1C(=O)O)c1ccccc1)OC(C)(C)C
Complexity: 396
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.6
CatalogNumber:
AB50130
ChemicalName:
(2S,4R)-Boc-4-phenyl-pyrrolidine-2-carboxylic acid
CasNumber:
336818-78-1
MolecularFormula:
C16H21NO4
MolecularWeight:
291.3422
MdlNumber:
MFCD06656435
Smiles:
O=C(N1C[C@H](C[C@H]1C(=O)O)c1ccccc1)OC(C)(C)C
Complexity:
396
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cnc2c(c1)cccc2Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cnc2c(c1)cccc2Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__