CS-0563656
1-Benzyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 859067-09-7
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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-Benzyl-2,4-dimethylpyrrole-3-carboxylic Acid
SMILES
CC1=CN(C(=C1C(=O)O)C)CC2=CC=CC=C2
Tpsa
42.23
Logp
2.85144
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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-Benzyl-2,4-dimethylpyrrole-3-carboxylic Acid
SMILES: CC1=CN(C(=C1C(=O)O)C)CC2=CC=CC=C2
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-Benzyl-2,4-dimethylpyrrole-3-carboxylic Acid
SMILES:
CC1=CN(C(=C1C(=O)O)C)CC2=CC=CC=C2
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: C₁₀H₁₄N₂O
Molecular Weight: 178.23
Synonyms: Pyridin-3-yl-(tetrahydro-furan-2-ylmethyl)-amine
SMILES: C1(CNC2=CC=CN=C2)OCCC1
Tpsa: 34.15
Logp: 1.6725
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:
C₁₀H₁₄N₂O
Molecular Weight:
178.23
Synonyms:
Pyridin-3-yl-(tetrahydro-furan-2-ylmethyl)-amine
SMILES:
C1(CNC2=CC=CN=C2)OCCC1
Tpsa:
34.15
Logp:
1.6725
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: C₁₁H₁₂N₂O
Molecular Weight: 188.23
Synonyms: None
SMILES: N=1OC(=CC1CNC=2C=CC=CC2)C
Tpsa: 38.06
Logp: 2.59512
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:
C₁₁H₁₂N₂O
Molecular Weight:
188.23
Synonyms:
None
SMILES:
N=1OC(=CC1CNC=2C=CC=CC2)C
Tpsa:
38.06
Logp:
2.59512
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: C₁₁H₁₈N₂S
Molecular Weight: 210.34
Synonyms: None
SMILES: C1CCN(C1)CCNCC2=CC=CS2
Tpsa: 15.27
Logp: 1.9335
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:
C₁₁H₁₈N₂S
Molecular Weight:
210.34
Synonyms:
None
SMILES:
C1CCN(C1)CCNCC2=CC=CS2
Tpsa:
15.27
Logp:
1.9335
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5