CS-0347454
Methyl 4-(2-bromo-5-fluorobenzamido)butanoate
Manufacturer: ChemScene
CAS Number: 1252132-81-2
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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
C₁₂H₁₃BrFNO₃
Molecular Weight
318.14
Synonyms
Butanoic acid, 4-[(2-bromo-5-fluorobenzoyl)amino]-, methyl ester
SMILES
O=C(OC)CCCNC(C1=CC(F)=CC=C1Br)=O
Tpsa
55.4
Logp
2.2712
H Acceptors
3
H Donors
1
Rotatable Bonds
5
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: C₁₂H₁₃BrFNO₃
Molecular Weight: 318.14
Synonyms: Butanoic acid, 4-[(2-bromo-5-fluorobenzoyl)amino]-, methyl ester
SMILES: O=C(OC)CCCNC(C1=CC(F)=CC=C1Br)=O
Tpsa: 55.4
Logp: 2.2712
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₃BrFNO₃
Molecular Weight:
318.14
Synonyms:
Butanoic acid, 4-[(2-bromo-5-fluorobenzoyl)amino]-, methyl ester
SMILES:
O=C(OC)CCCNC(C1=CC(F)=CC=C1Br)=O
Tpsa:
55.4
Logp:
2.2712
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₆N₂O₂S
Molecular Weight: 228.31
Synonyms: None
SMILES: O=C(OC)CCCNC(C1=NC=CS1)C
Tpsa: 51.22
Logp: 1.7469
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₆N₂O₂S
Molecular Weight:
228.31
Synonyms:
None
SMILES:
O=C(OC)CCCNC(C1=NC=CS1)C
Tpsa:
51.22
Logp:
1.7469
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅NO₂
Molecular Weight: 145.20
Synonyms: None
SMILES: O=C(OC)CCCNCC
Tpsa: 38.33
Logp: 0.5491
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₅NO₂
Molecular Weight:
145.20
Synonyms:
None
SMILES:
O=C(OC)CCCNCC
Tpsa:
38.33
Logp:
0.5491
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₁N₃O₄
Molecular Weight: 213.19
Synonyms: 1(2H)-Pyrimidinepropanoic acid, 5-amino-3,4-dihydro-2,4-dioxo-, methyl ester
SMILES: O=C(OC)CCN(C(N1)=O)C=C(N)C1=O
Tpsa: 107.18
Logp: -1.3181
H Acceptors: 6
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:
C₈H₁₁N₃O₄
Molecular Weight:
213.19
Synonyms:
1(2H)-Pyrimidinepropanoic acid, 5-amino-3,4-dihydro-2,4-dioxo-, methyl ester
SMILES:
O=C(OC)CCN(C(N1)=O)C=C(N)C1=O
Tpsa:
107.18
Logp:
-1.3181
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3