CS-1169107
1-(2-Chlorobenzyl)-4-nitro-1H-pyrazole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1281872-42-1
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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
C₁₁H₈ClN₃O₄
Molecular Weight
281.65
Synonyms
None
SMILES
O=C(O)C1=NN(C=C1N(=O)=O)CC=2C=CC=CC2Cl
Tpsa
N/A
Logp
N/A
H Acceptors
N/A
H Donors
N/A
Rotatable Bonds
N/A
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: C₁₁H₈ClN₃O₄
Molecular Weight: 281.65
Synonyms: None
SMILES: O=C(O)C1=NN(C=C1N(=O)=O)CC=2C=CC=CC2Cl
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₈ClN₃O₄
Molecular Weight:
281.65
Synonyms:
None
SMILES:
O=C(O)C1=NN(C=C1N(=O)=O)CC=2C=CC=CC2Cl
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉NO₃
Molecular Weight: 155.15
Synonyms: None
SMILES: O=C(O)C1C2OC(C=C2)C1N
Tpsa: 72.55
Logp: -0.6483
H Acceptors: 3
H Donors: 2
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:
C₇H₉NO₃
Molecular Weight:
155.15
Synonyms:
None
SMILES:
O=C(O)C1C2OC(C=C2)C1N
Tpsa:
72.55
Logp:
-0.6483
H Acceptors:
3
H Donors:
2
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: C₁₃H₁₉NO
Molecular Weight: 205.30
Synonyms: None
SMILES: O(C=1C=C(C=C(C1)CC)N(C)C)C2CC2
Tpsa: 12.47
Logp: 2.8562
H Acceptors: 2
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:
C₁₃H₁₉NO
Molecular Weight:
205.30
Synonyms:
None
SMILES:
O(C=1C=C(C=C(C1)CC)N(C)C)C2CC2
Tpsa:
12.47
Logp:
2.8562
H Acceptors:
2
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: C₇H₁₀N₂O₃S
Molecular Weight: 202.23
Synonyms: None
SMILES: O=S(=O)(NC=1C=C(O)C=C(N)C1)C
Tpsa: 92.42
Logp: 0.3459
H Acceptors: 4
H Donors: 3
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:
C₇H₁₀N₂O₃S
Molecular Weight:
202.23
Synonyms:
None
SMILES:
O=S(=O)(NC=1C=C(O)C=C(N)C1)C
Tpsa:
92.42
Logp:
0.3459
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
2