CS-0335654
4-Bromo-3-isobutyl-1-methyl-1H-pyrazole-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1020722-62-6
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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
C₉H₁₃BrN₂O₂
Molecular Weight
261.12
Synonyms
4-bromo-1-methyl-3-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
SMILES
CC(C)CC1=NN(C)C(=C1Br)C(=O)O
Tpsa
55.12
Logp
2.0793
H Acceptors
3
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1020722-62-6 | 1H-Pyrazole-5-carboxylic acid, 4-bromo-1-methyl-3-(2-methylpropyl)- | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₉H₁₃BrN₂O₂
Molecular Weight: 261.12
Synonyms: 4-bromo-1-methyl-3-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
SMILES: CC(C)CC1=NN(C)C(=C1Br)C(=O)O
Tpsa: 55.12
Logp: 2.0793
H Acceptors: 3
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:
C₉H₁₃BrN₂O₂
Molecular Weight:
261.12
Synonyms:
4-bromo-1-methyl-3-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
SMILES:
CC(C)CC1=NN(C)C(=C1Br)C(=O)O
Tpsa:
55.12
Logp:
2.0793
H Acceptors:
3
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: C₁₉H₂₃NO₅
Molecular Weight: 345.39
Synonyms: N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxybenzamide
SMILES: COC1=C(OC)C=C(CCNC(C2=CC(OC)=C(OC)C=C2)=O)C=C1
Tpsa: 66.02
Logp: 2.6935
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₃NO₅
Molecular Weight:
345.39
Synonyms:
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxybenzamide
SMILES:
COC1=C(OC)C=C(CCNC(C2=CC(OC)=C(OC)C=C2)=O)C=C1
Tpsa:
66.02
Logp:
2.6935
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
8
Purity: 98%
MDL No: MFCD06801408
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₇BrN₂O₃
Molecular Weight: 365.22
Synonyms: (2E)-3-{3-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)-methyl]-4-methoxyphenyl}acrylic acid
SMILES: CC1=NN(CC2=C(C=CC(=C2)/C=C/C(=O)O)OC)C(=C1Br)C
Tpsa: 64.35
Logp: 3.41714
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
MFCD06801408
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇BrN₂O₃
Molecular Weight:
365.22
Synonyms:
(2E)-3-{3-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)-methyl]-4-methoxyphenyl}acrylic acid
SMILES:
CC1=NN(CC2=C(C=CC(=C2)/C=C/C(=O)O)OC)C(=C1Br)C
Tpsa:
64.35
Logp:
3.41714
H Acceptors:
4
H Donors:
1
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: C₉H₁₃NO
Molecular Weight: 151.21
Synonyms: N-2-HYDROXYETHYL-M-TOLUIDINE
SMILES: CC1=CC(NCCO)=CC=C1
Tpsa: 32.26
Logp: 1.39922
H Acceptors: 2
H Donors: 2
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:
C₉H₁₃NO
Molecular Weight:
151.21
Synonyms:
N-2-HYDROXYETHYL-M-TOLUIDINE
SMILES:
CC1=CC(NCCO)=CC=C1
Tpsa:
32.26
Logp:
1.39922
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3