AD36190
3889-13-2 | 5-Nitro-3H-1,3-benzoxazol-2-one
Manufacturer: A2B Chem
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CatalogNumber
AD36190
ChemicalName
5-Nitro-3H-1,3-benzoxazol-2-one
CasNumber
3889-13-2
MolecularFormula
C7H4N2O4
MolecularWeight
180.1177
MdlNumber
MFCD01929029
Smiles
[O-][N+](=O)c1ccc2c(c1)[nH]c(=O)o2
NscNumber
98685
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
Xlogp3
1
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CatalogNumber: AD36190
ChemicalName: 5-Nitro-3H-1,3-benzoxazol-2-one
CasNumber: 3889-13-2
MolecularFormula: C7H4N2O4
MolecularWeight: 180.1177
MdlNumber: MFCD01929029
Smiles: [O-][N+](=O)c1ccc2c(c1)[nH]c(=O)o2
NscNumber: 98685
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
Xlogp3: 1
CatalogNumber:
AD36190
ChemicalName:
5-Nitro-3H-1,3-benzoxazol-2-one
CasNumber:
3889-13-2
MolecularFormula:
C7H4N2O4
MolecularWeight:
180.1177
MdlNumber:
MFCD01929029
Smiles:
[O-][N+](=O)c1ccc2c(c1)[nH]c(=O)o2
NscNumber:
98685
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccccc1c1ccccc1F
NscNumber: __
Complexity: 161
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 3.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccccc1c1ccccc1F
NscNumber:
__
Complexity:
161
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
3.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC(=O)N1CCC(CC1)C(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC(=O)N1CCC(CC1)C(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: AD36206
ChemicalName: 3,5-Dibromophenylboronic acid
CasNumber: 117695-55-3
MolecularFormula: C6H5BBr2O2
MolecularWeight: 279.7217
MdlNumber: MFCD01075725
Smiles: OB(c1cc(Br)cc(c1)Br)O
NscNumber: __
Complexity: 124
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
Xlogp3: __
CatalogNumber:
AD36206
ChemicalName:
3,5-Dibromophenylboronic acid
CasNumber:
117695-55-3
MolecularFormula:
C6H5BBr2O2
MolecularWeight:
279.7217
MdlNumber:
MFCD01075725
Smiles:
OB(c1cc(Br)cc(c1)Br)O
NscNumber:
__
Complexity:
124
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
Xlogp3:
__