AG77777
58960-13-7 | 2-Methyl-3,4-dihydro-2H-1,4-benzoxazine
Manufacturer: A2B Chem
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CatalogNumber
AG77777
ChemicalName
2-Methyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber
58960-13-7
MolecularFormula
C9H11NO
MolecularWeight
149.1897
MdlNumber
MFCD07364074
Smiles
CC1CNc2c(O1)cccc2
Complexity
138
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AG77777
ChemicalName: 2-Methyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber: 58960-13-7
MolecularFormula: C9H11NO
MolecularWeight: 149.1897
MdlNumber: MFCD07364074
Smiles: CC1CNc2c(O1)cccc2
Complexity: 138
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AG77777
ChemicalName:
2-Methyl-3,4-dihydro-2H-1,4-benzoxazine
CasNumber:
58960-13-7
MolecularFormula:
C9H11NO
MolecularWeight:
149.1897
MdlNumber:
MFCD07364074
Smiles:
CC1CNc2c(O1)cccc2
Complexity:
138
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
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MolecularFormula: __
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Smiles: [O-][N+](=O)c1ccc2c(c1)NCC(S2)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
[O-][N+](=O)c1ccc2c(c1)NCC(S2)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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UndefinedAtomStereocenterCount:
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Smiles: ClCC(=O)N1CC(C)(C)Sc2c1cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
ClCC(=O)N1CC(C)(C)Sc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
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MolecularFormula: __
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Smiles: Clc1ccc(cc1)C(=O)Nc1ccc(cc1C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(cc1)C(=O)Nc1ccc(cc1C)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__