CS-0541665
2-(3-Formyl-1H-pyrrol-2-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 153602-57-4
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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
C₇H₇NO₃
Molecular Weight
153.14
Synonyms
1H-Pyrrole-2-acetic acid, 3-formyl- (9CI)
SMILES
O=CC1=C(CC(O)=O)NC=C1
Tpsa
70.16
Logp
0.4543
H Acceptors
2
H Donors
2
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
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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: C₇H₇NO₃
Molecular Weight: 153.14
Synonyms: 1H-Pyrrole-2-acetic acid, 3-formyl- (9CI)
SMILES: O=CC1=C(CC(O)=O)NC=C1
Tpsa: 70.16
Logp: 0.4543
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:
C₇H₇NO₃
Molecular Weight:
153.14
Synonyms:
1H-Pyrrole-2-acetic acid, 3-formyl- (9CI)
SMILES:
O=CC1=C(CC(O)=O)NC=C1
Tpsa:
70.16
Logp:
0.4543
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: C₆H₅ClN₄
Molecular Weight: 168.58
Synonyms: None
SMILES: ClC1=CN2C(N)=CN=C2C=N1
Tpsa: 56.21
Logp: 0.9649
H Acceptors: 4
H Donors: 1
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:
C₆H₅ClN₄
Molecular Weight:
168.58
Synonyms:
None
SMILES:
ClC1=CN2C(N)=CN=C2C=N1
Tpsa:
56.21
Logp:
0.9649
H Acceptors:
4
H Donors:
1
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: C₁₀H₆F₄O
Molecular Weight: 218.15
Synonyms: None
SMILES: FC(F)(F)C(/C=C/C1=CC=C(C=C1)F)=O
Tpsa: 17.07
Logp: 2.9703
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₆F₄O
Molecular Weight:
218.15
Synonyms:
None
SMILES:
FC(F)(F)C(/C=C/C1=CC=C(C=C1)F)=O
Tpsa:
17.07
Logp:
2.9703
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₅BrN₂OSi
Molecular Weight: 333.34
Synonyms: None
SMILES: C[Si](CCOCN1N=C(CC)C(Br)=C1CC)(C)C
Tpsa: 27.05
Logp: 4.0827
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₅BrN₂OSi
Molecular Weight:
333.34
Synonyms:
None
SMILES:
C[Si](CCOCN1N=C(CC)C(Br)=C1CC)(C)C
Tpsa:
27.05
Logp:
4.0827
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
7