AB46821
672948-03-7 | Oxazole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB46821
ChemicalName
Oxazole-2-carboxylic acid
CasNumber
672948-03-7
MolecularFormula
C4H3NO3
MolecularWeight
113.0715
MdlNumber
MFCD04114935
Smiles
OC(=O)c1ncco1
Complexity
104
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.2
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CatalogNumber: AB46821
ChemicalName: Oxazole-2-carboxylic acid
CasNumber: 672948-03-7
MolecularFormula: C4H3NO3
MolecularWeight: 113.0715
MdlNumber: MFCD04114935
Smiles: OC(=O)c1ncco1
Complexity: 104
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AB46821
ChemicalName:
Oxazole-2-carboxylic acid
CasNumber:
672948-03-7
MolecularFormula:
C4H3NO3
MolecularWeight:
113.0715
MdlNumber:
MFCD04114935
Smiles:
OC(=O)c1ncco1
Complexity:
104
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.2
CatalogNumber: AB46822
ChemicalName: Oxetan-3-ol
CasNumber: 7748-36-9
MolecularFormula: C3H6O2
MolecularWeight: 74.0785
MdlNumber: MFCD09056790
Smiles: OC1COC1
Complexity: 31.9
Covalently-bondedUnitCount: 1
HeavyAtomCount: 5
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: -0.8
CatalogNumber:
AB46822
ChemicalName:
Oxetan-3-ol
CasNumber:
7748-36-9
MolecularFormula:
C3H6O2
MolecularWeight:
74.0785
MdlNumber:
MFCD09056790
Smiles:
OC1COC1
Complexity:
31.9
Covalently-bondedUnitCount:
1
HeavyAtomCount:
5
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
-0.8
CatalogNumber: AB46823
ChemicalName: 3-Oxetanamine
CasNumber: 21635-88-1
MolecularFormula: C3H7NO
MolecularWeight: 73.0938
MdlNumber: MFCD08544363
Smiles: NC1COC1
Complexity: 33.9
Covalently-bondedUnitCount: 1
HeavyAtomCount: 5
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: -1
CatalogNumber:
AB46823
ChemicalName:
3-Oxetanamine
CasNumber:
21635-88-1
MolecularFormula:
C3H7NO
MolecularWeight:
73.0938
MdlNumber:
MFCD08544363
Smiles:
NC1COC1
Complexity:
33.9
Covalently-bondedUnitCount:
1
HeavyAtomCount:
5
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
-1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC[C@@H](C1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)C
Complexity: 1870
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC[C@@H](C1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N)CC(C)C)C
Complexity:
1870
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-2.6