AI59686
88815-86-5 | tert-Butyl N-[1-(methylcarbamoyl)ethyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AI59686
ChemicalName
tert-Butyl N-[1-(methylcarbamoyl)ethyl]carbamate
CasNumber
88815-86-5
MolecularFormula
C9H18N2O3
MolecularWeight
202.2508
MdlNumber
MFCD01118780
Smiles
CNC(=O)C(NC(=O)OC(C)(C)C)C
Complexity
221
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.2
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CatalogNumber: AI59686
ChemicalName: tert-Butyl N-[1-(methylcarbamoyl)ethyl]carbamate
CasNumber: 88815-86-5
MolecularFormula: C9H18N2O3
MolecularWeight: 202.2508
MdlNumber: MFCD01118780
Smiles: CNC(=O)C(NC(=O)OC(C)(C)C)C
Complexity: 221
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.2
CatalogNumber:
AI59686
ChemicalName:
tert-Butyl N-[1-(methylcarbamoyl)ethyl]carbamate
CasNumber:
88815-86-5
MolecularFormula:
C9H18N2O3
MolecularWeight:
202.2508
MdlNumber:
MFCD01118780
Smiles:
CNC(=O)C(NC(=O)OC(C)(C)C)C
Complexity:
221
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.2
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Smiles: CN(C(=O)c1csc(n1)Br)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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Smiles:
CN(C(=O)c1csc(n1)Br)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: COC(=O)C1Cc2c(C1)c(ccc2)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
COC(=O)C1Cc2c(C1)c(ccc2)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCC(=O)ON5C(=O)CCC5=O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCC(=O)ON5C(=O)CCC5=O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__