CS-1087513
Methyl 5-nitro-1-(3-oxobutyl)-1H-indazole-6-carboxylate
Manufacturer: ChemScene
CAS Number: 2940953-99-9
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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
C₁₃H₁₃N₃O₅
Molecular Weight
291.26
Synonyms
None
SMILES
O=C(OC)C1=CC2=C(C=NN2CCC(=O)C)C=C1N(=O)=O
Tpsa
104.33
Logp
1.7102
H Acceptors
7
H Donors
0
Rotatable Bonds
5
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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: C₁₃H₁₃N₃O₅
Molecular Weight: 291.26
Synonyms: None
SMILES: O=C(OC)C1=CC2=C(C=NN2CCC(=O)C)C=C1N(=O)=O
Tpsa: 104.33
Logp: 1.7102
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃N₃O₅
Molecular Weight:
291.26
Synonyms:
None
SMILES:
O=C(OC)C1=CC2=C(C=NN2CCC(=O)C)C=C1N(=O)=O
Tpsa:
104.33
Logp:
1.7102
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆BrN₃O₃
Molecular Weight: 330.18
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC(=O)C2=CC(Br)=NN2CC1
Tpsa: 64.43
Logp: 2.079
H Acceptors: 5
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:
C₁₂H₁₆BrN₃O₃
Molecular Weight:
330.18
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC(=O)C2=CC(Br)=NN2CC1
Tpsa:
64.43
Logp:
2.079
H Acceptors:
5
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: C₇H₇F₃O₂
Molecular Weight: 180.12
Synonyms: None
SMILES: O=C(OC)C1=CC(C1)C(F)(F)F
Tpsa: 26.3
Logp: 1.668
H Acceptors: 2
H Donors: 0
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:
C₇H₇F₃O₂
Molecular Weight:
180.12
Synonyms:
None
SMILES:
O=C(OC)C1=CC(C1)C(F)(F)F
Tpsa:
26.3
Logp:
1.668
H Acceptors:
2
H Donors:
0
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: C₁₃H₁₄FN₃O₂
Molecular Weight: 263.27
Synonyms: None
SMILES: O=C(OC(C)(C)C)NC=1C(F)=CC=C2N=CC=NC21
Tpsa: 64.11
Logp: 3.1159
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₄FN₃O₂
Molecular Weight:
263.27
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NC=1C(F)=CC=C2N=CC=NC21
Tpsa:
64.11
Logp:
3.1159
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1