AB47735
252881-74-6 | tert-Butyl 12-amino-4,7,10-trioxadodecanoate
Manufacturer: A2B Chem
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CatalogNumber
AB47735
ChemicalName
tert-Butyl 12-amino-4,7,10-trioxadodecanoate
CasNumber
252881-74-6
MolecularFormula
C13H27NO5
MolecularWeight
277.3572
MdlNumber
MFCD06201017
Smiles
NCCOCCOCCOCCC(=O)OC(C)(C)C
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
13
Xlogp3
-0.3
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CatalogNumber: AB47735
ChemicalName: tert-Butyl 12-amino-4,7,10-trioxadodecanoate
CasNumber: 252881-74-6
MolecularFormula: C13H27NO5
MolecularWeight: 277.3572
MdlNumber: MFCD06201017
Smiles: NCCOCCOCCOCCC(=O)OC(C)(C)C
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 13
Xlogp3: -0.3
CatalogNumber:
AB47735
ChemicalName:
tert-Butyl 12-amino-4,7,10-trioxadodecanoate
CasNumber:
252881-74-6
MolecularFormula:
C13H27NO5
MolecularWeight:
277.3572
MdlNumber:
MFCD06201017
Smiles:
NCCOCCOCCOCCC(=O)OC(C)(C)C
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
13
Xlogp3:
-0.3
CatalogNumber: AB47736
ChemicalName: H2N-PEG6-OH
CasNumber: 39160-70-8
MolecularFormula: C12H27NO6
MolecularWeight: 281.3459
MdlNumber: MFCD22200781
Smiles: NCCOCCOCCOCCOCCOCCO
Complexity: 161
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 16
Xlogp3: -2.1
CatalogNumber:
AB47736
ChemicalName:
H2N-PEG6-OH
CasNumber:
39160-70-8
MolecularFormula:
C12H27NO6
MolecularWeight:
281.3459
MdlNumber:
MFCD22200781
Smiles:
NCCOCCOCCOCCOCCOCCO
Complexity:
161
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
16
Xlogp3:
-2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(NN)CC.Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(NN)CC.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB47738
ChemicalName: 3-(Difluoromethoxy)benzaldehyde
CasNumber: 85684-61-3
MolecularFormula: C8H6F2O2
MolecularWeight: 172.1288
MdlNumber: MFCD00236222
Smiles: O=Cc1cccc(c1)OC(F)F
Complexity: 150
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB47738
ChemicalName:
3-(Difluoromethoxy)benzaldehyde
CasNumber:
85684-61-3
MolecularFormula:
C8H6F2O2
MolecularWeight:
172.1288
MdlNumber:
MFCD00236222
Smiles:
O=Cc1cccc(c1)OC(F)F
Complexity:
150
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.8