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85310-57-2,MFCD12923678
Catalog No.:AA019T9Z

85310-57-2 | 3-(1H-pyrrol-3-yl)prop-2-enoic acid

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Technical Information
Catalog Number:
AA019T9Z
Chemical Name:
3-(1H-pyrrol-3-yl)prop-2-enoic acid
CAS Number:
85310-57-2
Molecular Formula:
C7H7NO2
Molecular Weight:
137.1360
MDL Number:
MFCD12923678
SMILES:
OC(=O)/C=C/c1c[nH]cc1
Properties
Computed Properties
 
Complexity:
154  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
0.7  

Literature
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Additional Info:
SDS
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Tags:85310-57-2 Molecular Formula|85310-57-2 MDL|85310-57-2 SMILES|85310-57-2 3-(1H-pyrrol-3-yl)prop-2-enoic acid