CS-1171417
Methyl 5-bromo-4-((tert-butoxycarbonyl)amino)pyrimidine-2-carboxylate
Manufacturer: ChemScene
CAS Number: 2680722-85-2
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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
C₁₁H₁₄BrN₃O₄
Molecular Weight
332.15
Synonyms
None
SMILES
O=C(C1=NC=C(Br)C(NC(OC(C)(C)C)=O)=N1)OC
Tpsa
90.41
Logp
2.3727
H Acceptors
6
H Donors
1
Rotatable Bonds
2
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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: C₁₁H₁₄BrN₃O₄
Molecular Weight: 332.15
Synonyms: None
SMILES: O=C(C1=NC=C(Br)C(NC(OC(C)(C)C)=O)=N1)OC
Tpsa: 90.41
Logp: 2.3727
H Acceptors: 6
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:
C₁₁H₁₄BrN₃O₄
Molecular Weight:
332.15
Synonyms:
None
SMILES:
O=C(C1=NC=C(Br)C(NC(OC(C)(C)C)=O)=N1)OC
Tpsa:
90.41
Logp:
2.3727
H Acceptors:
6
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: C₉H₁₁NO
Molecular Weight: 149.19
Synonyms: None
SMILES: OC[C@H]1NCC2=C1C=CC=C2
Tpsa: 32.26
Logp: 0.8232
H Acceptors: 2
H Donors: 2
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:
C₉H₁₁NO
Molecular Weight:
149.19
Synonyms:
None
SMILES:
OC[C@H]1NCC2=C1C=CC=C2
Tpsa:
32.26
Logp:
0.8232
H Acceptors:
2
H Donors:
2
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: C₁₃H₁₃IN₂O₂
Molecular Weight: 356.16
Synonyms: None
SMILES: O=CC1=CC2=C(N(C3CCCCO3)N=C2I)C=C1
Tpsa: 44.12
Logp: 3.1525
H Acceptors: 4
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:
C₁₃H₁₃IN₂O₂
Molecular Weight:
356.16
Synonyms:
None
SMILES:
O=CC1=CC2=C(N(C3CCCCO3)N=C2I)C=C1
Tpsa:
44.12
Logp:
3.1525
H Acceptors:
4
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: C₁₄H₁₉BrO₂
Molecular Weight: 299.20
Synonyms: None
SMILES: O=C(C(C)C1=CC=C(C(C)=C1)Br)OC(C)(C)C
Tpsa: 26.3
Logp: 4.20272
H Acceptors: 2
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:
C₁₄H₁₉BrO₂
Molecular Weight:
299.20
Synonyms:
None
SMILES:
O=C(C(C)C1=CC=C(C(C)=C1)Br)OC(C)(C)C
Tpsa:
26.3
Logp:
4.20272
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2