CS-0914318
1-(1,4,8,11-tetraazacyclotetradecan-1-yl)-2,2,2-trifluoroethan-1-one trihydrochloride
Manufacturer: ChemScene
CAS Number: 548488-49-9
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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
C₁₂H₂₃F₃N₄O
Molecular Weight
296.33
Synonyms
None
SMILES
O=C(N1CCNCCCNCCNCCC1)C(F)(F)F
Tpsa
56.4
Logp
-0.0601
H Acceptors
4
H Donors
3
Rotatable Bonds
0
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₂H₂₃F₃N₄O
Molecular Weight: 296.33
Synonyms: None
SMILES: O=C(N1CCNCCCNCCNCCC1)C(F)(F)F
Tpsa: 56.4
Logp: -0.0601
H Acceptors: 4
H Donors: 3
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:
C₁₂H₂₃F₃N₄O
Molecular Weight:
296.33
Synonyms:
None
SMILES:
O=C(N1CCNCCCNCCNCCC1)C(F)(F)F
Tpsa:
56.4
Logp:
-0.0601
H Acceptors:
4
H Donors:
3
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: C₁₄H₂₂F₆N₄O₂
Molecular Weight: 392.34
Synonyms: None
SMILES: O=C(N1CCNCCCN(C(=O)C(F)(F)F)CCNCCC1)C(F)(F)F
Tpsa: 64.68
Logp: 0.7412
H Acceptors: 4
H Donors: 2
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:
C₁₄H₂₂F₆N₄O₂
Molecular Weight:
392.34
Synonyms:
None
SMILES:
O=C(N1CCNCCCN(C(=O)C(F)(F)F)CCNCCC1)C(F)(F)F
Tpsa:
64.68
Logp:
0.7412
H Acceptors:
4
H Donors:
2
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: C₂₄H₃₆N₄O₄S₂
Molecular Weight: 508.70
Synonyms: None
SMILES: O=S(=O)(C1=CC=C(C=C1)C)N2CCNCCCNCCN(CCC2)S(=O)(=O)C3=CC=C(C=C3)C
Tpsa: 98.82
Logp: 1.95804
H Acceptors: 6
H Donors: 2
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:
C₂₄H₃₆N₄O₄S₂
Molecular Weight:
508.70
Synonyms:
None
SMILES:
O=S(=O)(C1=CC=C(C=C1)C)N2CCNCCCNCCN(CCC2)S(=O)(=O)C3=CC=C(C=C3)C
Tpsa:
98.82
Logp:
1.95804
H Acceptors:
6
H Donors:
2
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: C₁₈H₃₀N₄O
Molecular Weight: 318.46
Synonyms: None
SMILES: O=CC1=CC=C(C=C1)CN2CCNCCCNCCNCCC2
Tpsa: 56.4
Logp: 0.8637
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₃₀N₄O
Molecular Weight:
318.46
Synonyms:
None
SMILES:
O=CC1=CC=C(C=C1)CN2CCNCCCNCCNCCC2
Tpsa:
56.4
Logp:
0.8637
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
3