AB73504
1202805-23-9 | 2-(Ethoxycarbonylmethylamino)pyrimidine-5-boronic acid, pinacol ester
Manufacturer: A2B Chem
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CatalogNumber
AB73504
ChemicalName
2-(Ethoxycarbonylmethylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber
1202805-23-9
MolecularFormula
C14H22BN3O4
MolecularWeight
307.15317999999996
MdlNumber
MFCD12546563
Smiles
CCOC(=O)CNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity
382
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
1
RotatableBondCount
6
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CatalogNumber: AB73504
ChemicalName: 2-(Ethoxycarbonylmethylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber: 1202805-23-9
MolecularFormula: C14H22BN3O4
MolecularWeight: 307.15317999999996
MdlNumber: MFCD12546563
Smiles: CCOC(=O)CNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity: 382
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 6
CatalogNumber:
AB73504
ChemicalName:
2-(Ethoxycarbonylmethylamino)pyrimidine-5-boronic acid, pinacol ester
CasNumber:
1202805-23-9
MolecularFormula:
C14H22BN3O4
MolecularWeight:
307.15317999999996
MdlNumber:
MFCD12546563
Smiles:
CCOC(=O)CNc1ncc(cn1)B1OC(C(O1)(C)C)(C)C
Complexity:
382
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
6
CatalogNumber: AB73505
ChemicalName: (2-Ethoxycarbonyl)phenylboronic acid, propanediol cyclic ester
CasNumber: 850567-60-1
MolecularFormula: C12H15BO4
MolecularWeight: 234.0561
MdlNumber: MFCD06659932
Smiles: CCOC(=O)c1ccccc1B1OCCCO1
Complexity: 253
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
CatalogNumber:
AB73505
ChemicalName:
(2-Ethoxycarbonyl)phenylboronic acid, propanediol cyclic ester
CasNumber:
850567-60-1
MolecularFormula:
C12H15BO4
MolecularWeight:
234.0561
MdlNumber:
MFCD06659932
Smiles:
CCOC(=O)c1ccccc1B1OCCCO1
Complexity:
253
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
CatalogNumber: AB73506
ChemicalName: tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
CasNumber: 135716-08-4
MolecularFormula: C14H23NO4
MolecularWeight: 269.3367
MdlNumber: MFCD12912655
Smiles: CCOC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 358
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 5
CatalogNumber:
AB73506
ChemicalName:
tert-butyl 4-(2-ethoxy-2-oxoethylidene)piperidine-1-carboxylate
CasNumber:
135716-08-4
MolecularFormula:
C14H23NO4
MolecularWeight:
269.3367
MdlNumber:
MFCD12912655
Smiles:
CCOC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
358
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
5
CatalogNumber: AB73507
ChemicalName: Ethyl 3-indoleacetate
CasNumber: 778-82-5
MolecularFormula: C12H13NO2
MolecularWeight: 203.2371200000001
MdlNumber: MFCD00005635
Smiles: CCOC(=O)Cc1c[nH]c2c1cccc2
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 4
CatalogNumber:
AB73507
ChemicalName:
Ethyl 3-indoleacetate
CasNumber:
778-82-5
MolecularFormula:
C12H13NO2
MolecularWeight:
203.2371200000001
MdlNumber:
MFCD00005635
Smiles:
CCOC(=O)Cc1c[nH]c2c1cccc2
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
4