AD10058
99724-21-7 | (Azetidin-2-ylmethyl)carbamic acid tert-butyl ester hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AD10058
ChemicalName
(Azetidin-2-ylmethyl)carbamic acid tert-butyl ester hydrochloride
CasNumber
99724-21-7
MolecularFormula
C9H18N2O2
MolecularWeight
186.2514
MdlNumber
MFCD06658350
Smiles
O=C(OC(C)(C)C)NCC1CCN1
Complexity
187
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.7
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CatalogNumber: AD10058
ChemicalName: (Azetidin-2-ylmethyl)carbamic acid tert-butyl ester hydrochloride
CasNumber: 99724-21-7
MolecularFormula: C9H18N2O2
MolecularWeight: 186.2514
MdlNumber: MFCD06658350
Smiles: O=C(OC(C)(C)C)NCC1CCN1
Complexity: 187
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.7
CatalogNumber:
AD10058
ChemicalName:
(Azetidin-2-ylmethyl)carbamic acid tert-butyl ester hydrochloride
CasNumber:
99724-21-7
MolecularFormula:
C9H18N2O2
MolecularWeight:
186.2514
MdlNumber:
MFCD06658350
Smiles:
O=C(OC(C)(C)C)NCC1CCN1
Complexity:
187
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.7
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CC(c1cccc(c1)C(O)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(c1cccc(c1)C(O)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
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Smiles: COc1cc2c(O)n[nH]c2cc1
Complexity: __
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HeavyAtomCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1cc2c(O)n[nH]c2cc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: ClC(=O)c1ccc2c(c1)CC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)c1ccc2c(c1)CC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__