AB49356
3155-43-9 | 1,18-Octadecanediol
Manufacturer: A2B Chem
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CatalogNumber
AB49356
ChemicalName
1,18-Octadecanediol
CasNumber
3155-43-9
MolecularFormula
C18H38O2
MolecularWeight
286.4931
MdlNumber
MFCD17168570
Smiles
OCCCCCCCCCCCCCCCCCCO
Complexity
142
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
17
Xlogp3
6.8
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CatalogNumber: AB49356
ChemicalName: 1,18-Octadecanediol
CasNumber: 3155-43-9
MolecularFormula: C18H38O2
MolecularWeight: 286.4931
MdlNumber: MFCD17168570
Smiles: OCCCCCCCCCCCCCCCCCCO
Complexity: 142
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 17
Xlogp3: 6.8
CatalogNumber:
AB49356
ChemicalName:
1,18-Octadecanediol
CasNumber:
3155-43-9
MolecularFormula:
C18H38O2
MolecularWeight:
286.4931
MdlNumber:
MFCD17168570
Smiles:
OCCCCCCCCCCCCCCCCCCO
Complexity:
142
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
17
Xlogp3:
6.8
CatalogNumber: AB49357
ChemicalName: 4-(Bromomethyl)benzaldehyde
CasNumber: 51359-78-5
MolecularFormula: C8H7BrO
MolecularWeight: 199.0446
MdlNumber: MFCD08271963
Smiles: BrCc1ccc(cc1)C=O
Complexity: 106
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.9
CatalogNumber:
AB49357
ChemicalName:
4-(Bromomethyl)benzaldehyde
CasNumber:
51359-78-5
MolecularFormula:
C8H7BrO
MolecularWeight:
199.0446
MdlNumber:
MFCD08271963
Smiles:
BrCc1ccc(cc1)C=O
Complexity:
106
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1[nH]c2nccnc2c(=O)[nH]1
Complexity: 230
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -1
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1[nH]c2nccnc2c(=O)[nH]1
Complexity:
230
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-1
CatalogNumber: AB49359
ChemicalName: H-Glu(OtBu)-OtBu HCl
CasNumber: 32677-01-3
MolecularFormula: C13H26ClNO4
MolecularWeight: 295.8028
MdlNumber: MFCD00058003
Smiles: O=C(OC(C)(C)C)CC[C@@H](C(=O)OC(C)(C)C)N.Cl
Complexity: 299
Covalently-bondedUnitCount: 2
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: __
CatalogNumber:
AB49359
ChemicalName:
H-Glu(OtBu)-OtBu HCl
CasNumber:
32677-01-3
MolecularFormula:
C13H26ClNO4
MolecularWeight:
295.8028
MdlNumber:
MFCD00058003
Smiles:
O=C(OC(C)(C)C)CC[C@@H](C(=O)OC(C)(C)C)N.Cl
Complexity:
299
Covalently-bondedUnitCount:
2
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
__