CS-1090535
2-(5-Chloro-3-methyl-4-nitro-1H-pyrazol-1-yl)ethan-1-ol
Manufacturer: ChemScene
CAS Number: 42110-82-7
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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
C₆H₈ClN₃O₃
Molecular Weight
205.60
Synonyms
None
SMILES
O=N(=O)C1=C(Cl)N(N=C1C)CCO
Tpsa
81.19
Logp
0.74542
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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: C₆H₈ClN₃O₃
Molecular Weight: 205.60
Synonyms: None
SMILES: O=N(=O)C1=C(Cl)N(N=C1C)CCO
Tpsa: 81.19
Logp: 0.74542
H Acceptors: 5
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:
C₆H₈ClN₃O₃
Molecular Weight:
205.60
Synonyms:
None
SMILES:
O=N(=O)C1=C(Cl)N(N=C1C)CCO
Tpsa:
81.19
Logp:
0.74542
H Acceptors:
5
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: C₇H₈N₄O₃
Molecular Weight: 196.16
Synonyms: None
SMILES: N#CC1=C(C(=NN1CCO)C)N(=O)=O
Tpsa: 104.98
Logp: -0.0363
H Acceptors: 6
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:
C₇H₈N₄O₃
Molecular Weight:
196.16
Synonyms:
None
SMILES:
N#CC1=C(C(=NN1CCO)C)N(=O)=O
Tpsa:
104.98
Logp:
-0.0363
H Acceptors:
6
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: C₄H₉F₂NO
Molecular Weight: 125.12
Synonyms: None
SMILES: FC(F)C(O)(C)CN
Tpsa: 46.25
Logp: -0.0388
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₉F₂NO
Molecular Weight:
125.12
Synonyms:
None
SMILES:
FC(F)C(O)(C)CN
Tpsa:
46.25
Logp:
-0.0388
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃F₃O
Molecular Weight: 218.22
Synonyms: None
SMILES: O=C(C1CC2CCC1(C=C)C2)C(F)(F)F
Tpsa: 17.07
Logp: 3.1102
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃F₃O
Molecular Weight:
218.22
Synonyms:
None
SMILES:
O=C(C1CC2CCC1(C=C)C2)C(F)(F)F
Tpsa:
17.07
Logp:
3.1102
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2