AE72894
130457-35-1 | tert-Butyl (1-cyano-2-methylpropyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AE72894
ChemicalName
tert-Butyl (1-cyano-2-methylpropyl)carbamate
CasNumber
130457-35-1
MolecularFormula
C10H18N2O2
MolecularWeight
198.26211999999998
MdlNumber
MFCD00961556
Smiles
N#CC(C(C)C)NC(=O)OC(C)(C)C
Complexity
245
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AE72894
ChemicalName: tert-Butyl (1-cyano-2-methylpropyl)carbamate
CasNumber: 130457-35-1
MolecularFormula: C10H18N2O2
MolecularWeight: 198.26211999999998
MdlNumber: MFCD00961556
Smiles: N#CC(C(C)C)NC(=O)OC(C)(C)C
Complexity: 245
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AE72894
ChemicalName:
tert-Butyl (1-cyano-2-methylpropyl)carbamate
CasNumber:
130457-35-1
MolecularFormula:
C10H18N2O2
MolecularWeight:
198.26211999999998
MdlNumber:
MFCD00961556
Smiles:
N#CC(C(C)C)NC(=O)OC(C)(C)C
Complexity:
245
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
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Smiles: O=C(OC(C)(C)C)NC1COC1=O
Complexity: __
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RotatableBondCount: __
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Smiles:
O=C(OC(C)(C)C)NC1COC1=O
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: OC(=O)Cc1cccc2c1[nH]c1c2cccc1
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Smiles:
OC(=O)Cc1cccc2c1[nH]c1c2cccc1
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
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Smiles: CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC
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:
CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)(COC(=O)CCCCCCCCC)COC(=O)CCCCCCCCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__