CS-1021319
4-(But-3-yn-2-ylamino)-3-methylbenzoic acid
Manufacturer: ChemScene
CAS Number: 1600200-05-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₃NO₂
Molecular Weight
203.24
Synonyms
None
SMILES
O=C(O)C1=CC=C(NC(C#C)C)C(=C1)C
Tpsa
49.33
Logp
2.12682
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
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₃NO₂
Molecular Weight: 203.24
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(C#C)C)C(=C1)C
Tpsa: 49.33
Logp: 2.12682
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃NO₂
Molecular Weight:
203.24
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(C#C)C)C(=C1)C
Tpsa:
49.33
Logp:
2.12682
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₉IO
Molecular Weight: 282.16
Synonyms: None
SMILES: ICC1(O)CCC(CC1)C(C)C
Tpsa: 20.23
Logp: 2.9987
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₉IO
Molecular Weight:
282.16
Synonyms:
None
SMILES:
ICC1(O)CCC(CC1)C(C)C
Tpsa:
20.23
Logp:
2.9987
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁N₃O₂
Molecular Weight: 205.21
Synonyms: None
SMILES: O=C(O)C1=NN=C(C=C1)NCCC#CC
Tpsa: 75.11
Logp: 1.0001
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₁N₃O₂
Molecular Weight:
205.21
Synonyms:
None
SMILES:
O=C(O)C1=NN=C(C=C1)NCCC#CC
Tpsa:
75.11
Logp:
1.0001
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₉NOS
Molecular Weight: 203.26
Synonyms: None
SMILES: O=CC1=CN=CC(=C1)C=2C=CSC2C
Tpsa: 29.96
Logp: 2.93102
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₉NOS
Molecular Weight:
203.26
Synonyms:
None
SMILES:
O=CC1=CN=CC(=C1)C=2C=CSC2C
Tpsa:
29.96
Logp:
2.93102
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2