CS-1075030
1-Benzyl-4-nitro-1H-pyrrole-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 265664-77-5
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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
C₁₂H₁₀N₂O₄
Molecular Weight
246.22
Synonyms
None
SMILES
O=C(O)C1=CC(=CN1CC=2C=CC=CC2)N(=O)=O
Tpsa
85.37
Logp
2.1428
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₁₂H₁₀N₂O₄
Molecular Weight: 246.22
Synonyms: None
SMILES: O=C(O)C1=CC(=CN1CC=2C=CC=CC2)N(=O)=O
Tpsa: 85.37
Logp: 2.1428
H Acceptors: 4
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:
C₁₂H₁₀N₂O₄
Molecular Weight:
246.22
Synonyms:
None
SMILES:
O=C(O)C1=CC(=CN1CC=2C=CC=CC2)N(=O)=O
Tpsa:
85.37
Logp:
2.1428
H Acceptors:
4
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: C₁₂H₇NO
Molecular Weight: 181.19
Synonyms: None
SMILES: O=C(C#C)C=1N=C2C=CC=CC2=CC1
Tpsa: 29.96
Logp: 2.0507
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:
C₁₂H₇NO
Molecular Weight:
181.19
Synonyms:
None
SMILES:
O=C(C#C)C=1N=C2C=CC=CC2=CC1
Tpsa:
29.96
Logp:
2.0507
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: C₁₀H₈N₄O₂
Molecular Weight: 216.20
Synonyms: None
SMILES: N#CCCC=1C=NC2=NC(=CN2C1)C(=O)O
Tpsa: 91.28
Logp: 0.88368
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:
C₁₀H₈N₄O₂
Molecular Weight:
216.20
Synonyms:
None
SMILES:
N#CCCC=1C=NC2=NC(=CN2C1)C(=O)O
Tpsa:
91.28
Logp:
0.88368
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: C₁₁H₁₃N₃O₂
Molecular Weight: 219.24
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1N=CC=2C=NC=CC21
Tpsa: 57.01
Logp: 2.2145
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:
C₁₁H₁₃N₃O₂
Molecular Weight:
219.24
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1N=CC=2C=NC=CC21
Tpsa:
57.01
Logp:
2.2145
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
0