CS-0602094
(E)-3-(1-(3-methylbenzyl)-1H-pyrrol-2-yl)acrylic acid
Manufacturer: ChemScene
CAS Number: 1173408-13-3
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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
C₁₅H₁₅NO₂
Molecular Weight
241.29
Synonyms
None
SMILES
CC1=CC(=CC=C1)CN2C=CC=C2/C=C/C(=O)O
Tpsa
42.23
Logp
2.94262
H Acceptors
2
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: C₁₅H₁₅NO₂
Molecular Weight: 241.29
Synonyms: None
SMILES: CC1=CC(=CC=C1)CN2C=CC=C2/C=C/C(=O)O
Tpsa: 42.23
Logp: 2.94262
H Acceptors: 2
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:
C₁₅H₁₅NO₂
Molecular Weight:
241.29
Synonyms:
None
SMILES:
CC1=CC(=CC=C1)CN2C=CC=C2/C=C/C(=O)O
Tpsa:
42.23
Logp:
2.94262
H Acceptors:
2
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: C₁₁H₁₄N₂O₄
Molecular Weight: 238.24
Synonyms: None
SMILES: CCOC(=O)C1=C(NC(=C1/C=C/[N+](=O)[O-])C)C
Tpsa: 85.23
Logp: 2.05564
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:
C₁₁H₁₄N₂O₄
Molecular Weight:
238.24
Synonyms:
None
SMILES:
CCOC(=O)C1=C(NC(=C1/C=C/[N+](=O)[O-])C)C
Tpsa:
85.23
Logp:
2.05564
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: C₁₇H₁₉N₅
Molecular Weight: 293.37
Synonyms: None
SMILES: C1CN(CCN1)CC2=NC3=C(N2C4=CC=CC=C4)N=CC=C3
Tpsa: 45.98
Logp: 1.8257
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:
C₁₇H₁₉N₅
Molecular Weight:
293.37
Synonyms:
None
SMILES:
C1CN(CCN1)CC2=NC3=C(N2C4=CC=CC=C4)N=CC=C3
Tpsa:
45.98
Logp:
1.8257
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: C₁₁H₁₁NO₄S
Molecular Weight: 253.27
Synonyms: None
SMILES: COC(=O)CN1C2=C(C=C1C(=O)OC)SC=C2
Tpsa: 57.53
Logp: 1.6624
H Acceptors: 6
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:
C₁₁H₁₁NO₄S
Molecular Weight:
253.27
Synonyms:
None
SMILES:
COC(=O)CN1C2=C(C=C1C(=O)OC)SC=C2
Tpsa:
57.53
Logp:
1.6624
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3