CS-1066758
Methyl 2-(5-chloro-3-oxo-2,3-dihydro-1H-pyrazol-1-yl)acetate
Manufacturer: ChemScene
CAS Number: 2816596-05-9
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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
C₆H₇ClN₂O₃
Molecular Weight
190.58
Synonyms
None
SMILES
O=C1C=C(Cl)N(N1)CC(=O)OC
Tpsa
64.09
Logp
0.0028
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₆H₇ClN₂O₃
Molecular Weight: 190.58
Synonyms: None
SMILES: O=C1C=C(Cl)N(N1)CC(=O)OC
Tpsa: 64.09
Logp: 0.0028
H Acceptors: 4
H Donors: 1
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:
C₆H₇ClN₂O₃
Molecular Weight:
190.58
Synonyms:
None
SMILES:
O=C1C=C(Cl)N(N1)CC(=O)OC
Tpsa:
64.09
Logp:
0.0028
H Acceptors:
4
H Donors:
1
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: C₇H₁₁BrO
Molecular Weight: 191.07
Synonyms: None
SMILES: BrC1CC2(COCC2)C1
Tpsa: 9.23
Logp: 1.9504
H Acceptors: 1
H Donors: 0
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:
C₇H₁₁BrO
Molecular Weight:
191.07
Synonyms:
None
SMILES:
BrC1CC2(COCC2)C1
Tpsa:
9.23
Logp:
1.9504
H Acceptors:
1
H Donors:
0
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: C₁₄H₁₄F₃NO₃
Molecular Weight: 301.26
Synonyms: None
SMILES: O=C(NC(COC)C(F)(F)F)C=1OC2=CC=CC(=C2C1)C
Tpsa: 51.47
Logp: 3.04832
H Acceptors: 3
H Donors: 1
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:
C₁₄H₁₄F₃NO₃
Molecular Weight:
301.26
Synonyms:
None
SMILES:
O=C(NC(COC)C(F)(F)F)C=1OC2=CC=CC(=C2C1)C
Tpsa:
51.47
Logp:
3.04832
H Acceptors:
3
H Donors:
1
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: C₁₁H₁₄BrN
Molecular Weight: 240.14
Synonyms: None
SMILES: N[C@@H]1C=2C(CC1(C)C)=CC(Br)=CC2
Tpsa: 26.02
Logp: 3.0312
H Acceptors: 1
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:
C₁₁H₁₄BrN
Molecular Weight:
240.14
Synonyms:
None
SMILES:
N[C@@H]1C=2C(CC1(C)C)=CC(Br)=CC2
Tpsa:
26.02
Logp:
3.0312
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0