CS-1099666
7H-Pyrrolo[2,3-d]pyrimidine-7-propanoic acid, 4-amino-5-iodo-, 1,1-dimethylethyl ester
Manufacturer: ChemScene
CAS Number: 2845102-95-4
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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
C₁₃H₁₇IN₄O₂
Molecular Weight
388.20
Synonyms
None
SMILES
O=C(OC(C)(C)C)CCN1C=C(I)C2=C(N)N=CN=C21
Tpsa
83.03
Logp
2.3499
H Acceptors
6
H Donors
1
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇IN₄O₂
Molecular Weight: 388.20
Synonyms: None
SMILES: O=C(OC(C)(C)C)CCN1C=C(I)C2=C(N)N=CN=C21
Tpsa: 83.03
Logp: 2.3499
H Acceptors: 6
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:
C₁₃H₁₇IN₄O₂
Molecular Weight:
388.20
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CCN1C=C(I)C2=C(N)N=CN=C21
Tpsa:
83.03
Logp:
2.3499
H Acceptors:
6
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: C₁₂H₉NOS
Molecular Weight: 215.27
Synonyms: None
SMILES: NC(C=C1S2)=CC=C1OC3=C2C=CC=C3
Tpsa: 35.25
Logp: 3.5257
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉NOS
Molecular Weight:
215.27
Synonyms:
None
SMILES:
NC(C=C1S2)=CC=C1OC3=C2C=CC=C3
Tpsa:
35.25
Logp:
3.5257
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃
Molecular Weight: 147.18
Synonyms: None
SMILES: NCC1=CN2C(C=NC=C2)=C1
Tpsa: 43.32
Logp: 0.793
H Acceptors: 3
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:
C₈H₉N₃
Molecular Weight:
147.18
Synonyms:
None
SMILES:
NCC1=CN2C(C=NC=C2)=C1
Tpsa:
43.32
Logp:
0.793
H Acceptors:
3
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: C₁₀H₁₀BrNO₃
Molecular Weight: 272.10
Synonyms: None
SMILES: O=[N+](C1=C(OC(C)(C)C2)C2=C(Br)C=C1)[O-]
Tpsa: 52.37
Logp: 3.0708
H Acceptors: 3
H Donors: 0
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:
C₁₀H₁₀BrNO₃
Molecular Weight:
272.10
Synonyms:
None
SMILES:
O=[N+](C1=C(OC(C)(C)C2)C2=C(Br)C=C1)[O-]
Tpsa:
52.37
Logp:
3.0708
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1