CS-0560651
1-(2,5-Dimethylbenzyl)-1H-pyrrole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1519239-79-2
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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
C₁₄H₁₅NO₂
Molecular Weight
229.27
Synonyms
1-[(2,5-dimethylphenyl)methyl]-1h-pyrrole-3-carboxylic acid
SMILES
CC1=CC(=C(C=C1)C)CN2C=CC(=C2)C(=O)O
Tpsa
42.23
Logp
2.85144
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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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: C₁₄H₁₅NO₂
Molecular Weight: 229.27
Synonyms: 1-[(2,5-dimethylphenyl)methyl]-1h-pyrrole-3-carboxylic acid
SMILES: CC1=CC(=C(C=C1)C)CN2C=CC(=C2)C(=O)O
Tpsa: 42.23
Logp: 2.85144
H Acceptors: 2
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:
C₁₄H₁₅NO₂
Molecular Weight:
229.27
Synonyms:
1-[(2,5-dimethylphenyl)methyl]-1h-pyrrole-3-carboxylic acid
SMILES:
CC1=CC(=C(C=C1)C)CN2C=CC(=C2)C(=O)O
Tpsa:
42.23
Logp:
2.85144
H Acceptors:
2
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: C₁₀H₁₃IN₂O₂
Molecular Weight: 320.13
Synonyms: None
SMILES: IC1=CN=CN=C1OCC2CCOCC2
Tpsa: 44.24
Logp: 1.8866
H Acceptors: 4
H Donors: 0
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:
C₁₀H₁₃IN₂O₂
Molecular Weight:
320.13
Synonyms:
None
SMILES:
IC1=CN=CN=C1OCC2CCOCC2
Tpsa:
44.24
Logp:
1.8866
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₆N₂O₃
Molecular Weight: 224.26
Synonyms: 1-[(diethylcarbamoyl)methyl]-1h-pyrrole-3-carboxylic acid
SMILES: O=C(C1=CN(CC(N(CC)CC)=O)C=C1)O
Tpsa: 62.54
Logp: 1.0547
H Acceptors: 3
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:
C₁₁H₁₆N₂O₃
Molecular Weight:
224.26
Synonyms:
1-[(diethylcarbamoyl)methyl]-1h-pyrrole-3-carboxylic acid
SMILES:
O=C(C1=CN(CC(N(CC)CC)=O)C=C1)O
Tpsa:
62.54
Logp:
1.0547
H Acceptors:
3
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: C₁₁H₁₆N₂O₃
Molecular Weight: 224.26
Synonyms: None
SMILES: CCN(CC)C(=O)CN1C=CC=C1C(=O)O
Tpsa: 62.54
Logp: 1.0547
H Acceptors: 3
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:
C₁₁H₁₆N₂O₃
Molecular Weight:
224.26
Synonyms:
None
SMILES:
CCN(CC)C(=O)CN1C=CC=C1C(=O)O
Tpsa:
62.54
Logp:
1.0547
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5