CS-0914683
Carboxyamidotriazole Impurity 1
Manufacturer: ChemScene
CAS Number: 99508-25-5
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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
C₁₄H₉Cl₃O₂
Molecular Weight
315.58
Synonyms
None
SMILES
O=C(C1=CC=C(Cl)C=C1)C2=C(Cl)C=C(C=C2Cl)CO
Tpsa
37.3
Logp
4.3701
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 99508-25-5 | | A2B Chem | -- |
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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: C₁₄H₉Cl₃O₂
Molecular Weight: 315.58
Synonyms: None
SMILES: O=C(C1=CC=C(Cl)C=C1)C2=C(Cl)C=C(C=C2Cl)CO
Tpsa: 37.3
Logp: 4.3701
H Acceptors: 2
H Donors: 1
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:
C₁₄H₉Cl₃O₂
Molecular Weight:
315.58
Synonyms:
None
SMILES:
O=C(C1=CC=C(Cl)C=C1)C2=C(Cl)C=C(C=C2Cl)CO
Tpsa:
37.3
Logp:
4.3701
H Acceptors:
2
H Donors:
1
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: C₂₅H₃₃N₃O₄
Molecular Weight: 439.55
Synonyms: None
SMILES: [C@H](C(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)(NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C
Tpsa: 121.52
Logp: 2.2895
H Acceptors: 4
H Donors: 4
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₃N₃O₄
Molecular Weight:
439.55
Synonyms:
None
SMILES:
[C@H](C(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)(NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C
Tpsa:
121.52
Logp:
2.2895
H Acceptors:
4
H Donors:
4
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₃₉N₃O₄
Molecular Weight: 529.67
Synonyms: None
SMILES: [C@@H](CC1=CC=CC=C1)(NC([C@@H](NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C)=O)C(OCC3=CC=CC=C3)=O
Tpsa: 110.52
Logp: 3.9483
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₃₉N₃O₄
Molecular Weight:
529.67
Synonyms:
None
SMILES:
[C@@H](CC1=CC=CC=C1)(NC([C@@H](NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C)=O)C(OCC3=CC=CC=C3)=O
Tpsa:
110.52
Logp:
3.9483
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₆H₄₉F₃N₄O₇
Molecular Weight: 706.79
Synonyms: None
SMILES: C(C(O)=O)(F)(F)F.C([C@@H](NC([C@H](CC1=CC=CC=C1)NC([C@@H](NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C)=O)=O)CC(C)C)(=O)[C@@]3(C)CO3
Tpsa: 180.22
Logp: 3.7271
H Acceptors: 7
H Donors: 5
Rotatable Bonds: 17
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₆H₄₉F₃N₄O₇
Molecular Weight:
706.79
Synonyms:
None
SMILES:
C(C(O)=O)(F)(F)F.C([C@@H](NC([C@H](CC1=CC=CC=C1)NC([C@@H](NC([C@H](CCC2=CC=CC=C2)N)=O)CC(C)C)=O)=O)CC(C)C)(=O)[C@@]3(C)CO3
Tpsa:
180.22
Logp:
3.7271
H Acceptors:
7
H Donors:
5
Rotatable Bonds:
17