AG79853
58960-12-6 | 2,7-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine
Manufacturer: A2B Chem
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CatalogNumber
AG79853
ChemicalName
2,7-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber
58960-12-6
MolecularFormula
C10H13NO
MolecularWeight
163.2163
MdlNumber
MFCD11603429
Smiles
CC1CNc2c(O1)cc(cc2)C
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.4
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CatalogNumber: AG79853
ChemicalName: 2,7-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber: 58960-12-6
MolecularFormula: C10H13NO
MolecularWeight: 163.2163
MdlNumber: MFCD11603429
Smiles: CC1CNc2c(O1)cc(cc2)C
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.4
CatalogNumber:
AG79853
ChemicalName:
2,7-Dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber:
58960-12-6
MolecularFormula:
C10H13NO
MolecularWeight:
163.2163
MdlNumber:
MFCD11603429
Smiles:
CC1CNc2c(O1)cc(cc2)C
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.4
CatalogNumber: AG79855
ChemicalName: Diphenyl 1-(Cbz-Amino)isobutylphosphonate
CasNumber: 65164-83-2
MolecularFormula: C24H26NO5P
MolecularWeight: 439.4407
MdlNumber: MFCD03158925
Smiles: O=C(NC(P(=O)(Oc1ccccc1)Oc1ccccc1)C(C)C)OCc1ccccc1
Complexity: 557
Covalently-bondedUnitCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 5.8
CatalogNumber:
AG79855
ChemicalName:
Diphenyl 1-(Cbz-Amino)isobutylphosphonate
CasNumber:
65164-83-2
MolecularFormula:
C24H26NO5P
MolecularWeight:
439.4407
MdlNumber:
MFCD03158925
Smiles:
O=C(NC(P(=O)(Oc1ccccc1)Oc1ccccc1)C(C)C)OCc1ccccc1
Complexity:
557
Covalently-bondedUnitCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
5.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C(=O)N1CCCC1)N
Complexity: 130
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: -0.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C(=O)N1CCCC1)N
Complexity:
130
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
-0.3
CatalogNumber: AG79857
ChemicalName: 2-(Ethanesulfonyl)-3-nitropyridine
CasNumber: 56825-33-3
MolecularFormula: C7H8N2O4S
MolecularWeight: 216.2144
MdlNumber: MFCD25121758
Smiles: CCS(=O)(=O)c1ncccc1[N+](=O)[O-]
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.6
CatalogNumber:
AG79857
ChemicalName:
2-(Ethanesulfonyl)-3-nitropyridine
CasNumber:
56825-33-3
MolecularFormula:
C7H8N2O4S
MolecularWeight:
216.2144
MdlNumber:
MFCD25121758
Smiles:
CCS(=O)(=O)c1ncccc1[N+](=O)[O-]
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.6