CS-0583946
2-Methyl-5-(2-methylbutanamido)benzoic acid
Manufacturer: ChemScene
CAS Number: 1405353-18-5
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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
C₁₃H₁₇NO₃
Molecular Weight
235.28
Synonyms
None
SMILES
O=C(O)C1=CC(NC(C(C)CC)=O)=CC=C1C
Tpsa
66.4
Logp
2.67782
H Acceptors
2
H Donors
2
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: C₁₃H₁₇NO₃
Molecular Weight: 235.28
Synonyms: None
SMILES: O=C(O)C1=CC(NC(C(C)CC)=O)=CC=C1C
Tpsa: 66.4
Logp: 2.67782
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₇NO₃
Molecular Weight:
235.28
Synonyms:
None
SMILES:
O=C(O)C1=CC(NC(C(C)CC)=O)=CC=C1C
Tpsa:
66.4
Logp:
2.67782
H Acceptors:
2
H Donors:
2
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: C₁₁H₁₃F₃N₂O
Molecular Weight: 246.23
Synonyms: 1-{[4-(Trifluoromethoxy)phenyl]methyl}azetidin-3-amine
SMILES: C1C(CN1CC2=CC=C(C=C2)OC(F)(F)F)N
Tpsa: 38.49
Logp: 1.7281
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:
C₁₁H₁₃F₃N₂O
Molecular Weight:
246.23
Synonyms:
1-{[4-(Trifluoromethoxy)phenyl]methyl}azetidin-3-amine
SMILES:
C1C(CN1CC2=CC=C(C=C2)OC(F)(F)F)N
Tpsa:
38.49
Logp:
1.7281
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: C₁₁H₁₄BrNO₂
Molecular Weight: 272.14
Synonyms: None
SMILES: CCOC(=O)C(C)(C)C1=CC(=CN=C1)Br
Tpsa: 39.19
Logp: 2.6848
H Acceptors: 3
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:
C₁₁H₁₄BrNO₂
Molecular Weight:
272.14
Synonyms:
None
SMILES:
CCOC(=O)C(C)(C)C1=CC(=CN=C1)Br
Tpsa:
39.19
Logp:
2.6848
H Acceptors:
3
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: C₇H₃F₄NO₃
Molecular Weight: 225.10
Synonyms: None
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])OC(F)(F)F)F
Tpsa: 52.37
Logp: 2.6325
H Acceptors: 3
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:
C₇H₃F₄NO₃
Molecular Weight:
225.10
Synonyms:
None
SMILES:
C1=CC(=C(C=C1[N+](=O)[O-])OC(F)(F)F)F
Tpsa:
52.37
Logp:
2.6325
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2