CS-1075406
Tert-butyl 4-hydroxy-4-(trichloromethyl)azepane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2680779-62-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₂₀Cl₃NO₃
Molecular Weight
332.65
Synonyms
None
SMILES
O=C(OC(C)(C)C)N1CCCC(O)(CC1)C(Cl)(Cl)Cl
Tpsa
49.77
Logp
3.5087
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₀Cl₃NO₃
Molecular Weight: 332.65
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCCC(O)(CC1)C(Cl)(Cl)Cl
Tpsa: 49.77
Logp: 3.5087
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₀Cl₃NO₃
Molecular Weight:
332.65
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCCC(O)(CC1)C(Cl)(Cl)Cl
Tpsa:
49.77
Logp:
3.5087
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆ClNO₃
Molecular Weight: 269.72
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CC(OC)(CCl)C2
Tpsa: 38.77
Logp: 2.2628
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆ClNO₃
Molecular Weight:
269.72
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CC(OC)(CCl)C2
Tpsa:
38.77
Logp:
2.2628
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂FN₃O₂
Molecular Weight: 213.21
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC1=NC=CC(F)=N1
Tpsa: 64.11
Logp: 1.9627
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂FN₃O₂
Molecular Weight:
213.21
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC1=NC=CC(F)=N1
Tpsa:
64.11
Logp:
1.9627
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₆N₂O₄
Molecular Weight: 276.29
Synonyms: None
SMILES: O=C(O)C1=NN(C(=O)OC(C)(C)C)C2=C1C=CC=C2C
Tpsa: 81.42
Logp: 2.82612
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₆N₂O₄
Molecular Weight:
276.29
Synonyms:
None
SMILES:
O=C(O)C1=NN(C(=O)OC(C)(C)C)C2=C1C=CC=C2C
Tpsa:
81.42
Logp:
2.82612
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1