CS-1090223
3-(5-Formyl-2,4-dimethyl-1H-pyrrol-3-yl)propyl acetate
Manufacturer: ChemScene
CAS Number: 402732-09-6
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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
C₁₂H₁₇NO₃
Molecular Weight
223.27
Synonyms
None
SMILES
O=CC=1NC(=C(C1C)CCCOC(=O)C)C
Tpsa
59.16
Logp
1.93974
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: C₁₂H₁₇NO₃
Molecular Weight: 223.27
Synonyms: None
SMILES: O=CC=1NC(=C(C1C)CCCOC(=O)C)C
Tpsa: 59.16
Logp: 1.93974
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:
C₁₂H₁₇NO₃
Molecular Weight:
223.27
Synonyms:
None
SMILES:
O=CC=1NC(=C(C1C)CCCOC(=O)C)C
Tpsa:
59.16
Logp:
1.93974
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₇Br₂NO₃
Molecular Weight: 373.00
Synonyms: None
SMILES: O=N(=O)C1=CC=C(OC2=CC=C(Br)C=C2)C(Br)=C1
Tpsa: 52.37
Logp: 4.9121
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₇Br₂NO₃
Molecular Weight:
373.00
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C(OC2=CC=C(Br)C=C2)C(Br)=C1
Tpsa:
52.37
Logp:
4.9121
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: C₁₆H₁₈O₅
Molecular Weight: 290.31
Synonyms: None
SMILES: O=C(OC(C)C)C=1C=CC=2OC(=CC2C1)CCC(=O)OC
Tpsa: 65.74
Logp: 3.1036
H Acceptors: 5
H Donors: 0
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:
C₁₆H₁₈O₅
Molecular Weight:
290.31
Synonyms:
None
SMILES:
O=C(OC(C)C)C=1C=CC=2OC(=CC2C1)CCC(=O)OC
Tpsa:
65.74
Logp:
3.1036
H Acceptors:
5
H Donors:
0
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: C₁₃H₁₄O₂
Molecular Weight: 202.25
Synonyms: None
SMILES: O=CC=1C=CC=2OC(=CC2C1)CCCC
Tpsa: 30.21
Logp: 3.5879
H Acceptors: 2
H Donors: 0
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:
C₁₃H₁₄O₂
Molecular Weight:
202.25
Synonyms:
None
SMILES:
O=CC=1C=CC=2OC(=CC2C1)CCCC
Tpsa:
30.21
Logp:
3.5879
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4