CS-0540892
3-(2-Amino-2-oxoethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 333991-43-8
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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
C₉H₉NO₃
Molecular Weight
179.17
Synonyms
None
SMILES
C1=CC(=CC(=C1)C(=O)O)CC(=O)N
Tpsa
80.39
Logp
0.4126
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: C₉H₉NO₃
Molecular Weight: 179.17
Synonyms: None
SMILES: C1=CC(=CC(=C1)C(=O)O)CC(=O)N
Tpsa: 80.39
Logp: 0.4126
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:
C₉H₉NO₃
Molecular Weight:
179.17
Synonyms:
None
SMILES:
C1=CC(=CC(=C1)C(=O)O)CC(=O)N
Tpsa:
80.39
Logp:
0.4126
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: C₅H₈FNO
Molecular Weight: 117.12
Synonyms: None
SMILES: O=C(C1(F)CCC1)N
Tpsa: 43.09
Logp: 0.3639
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈FNO
Molecular Weight:
117.12
Synonyms:
None
SMILES:
O=C(C1(F)CCC1)N
Tpsa:
43.09
Logp:
0.3639
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃Cl₂N₃
Molecular Weight: 234.13
Synonyms: None
SMILES: C1=CC2=NC=C(N2C=C1)CCN.Cl.Cl
Tpsa: 43.32
Logp: 1.6791
H Acceptors: 3
H Donors: 1
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:
C₉H₁₃Cl₂N₃
Molecular Weight:
234.13
Synonyms:
None
SMILES:
C1=CC2=NC=C(N2C=C1)CCN.Cl.Cl
Tpsa:
43.32
Logp:
1.6791
H Acceptors:
3
H Donors:
1
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: C₅H₁₀N₄
Molecular Weight: 126.16
Synonyms: 2-(1-Methyl-1H-1,2,4-triazol-3-yl)ethanamine
SMILES: CN1C=NC(=N1)CCN
Tpsa: 56.73
Logp: -0.6837
H Acceptors: 4
H Donors: 1
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:
C₅H₁₀N₄
Molecular Weight:
126.16
Synonyms:
2-(1-Methyl-1H-1,2,4-triazol-3-yl)ethanamine
SMILES:
CN1C=NC(=N1)CCN
Tpsa:
56.73
Logp:
-0.6837
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2