1-Methyl-1H-pyrrole-2-carboxylic acid
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1-Methyl-1H-pyrrole-2-carboxylic acid
structure -
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CAS No:
6973-60-0
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Formula:
C6H7NO2
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Chemical Name:
1-Methyl-1H-pyrrole-2-carboxylic acid
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Synonyms:
1H-Pyrrole-2-carboxylic acid,1-methyl-;Pyrrole-2-carboxylic acid,1-methyl-;1-Methyl-1H-pyrrole-2-carboxylic acid;N-Methyl-2-pyrrolecarboxylic acid;1-Methyl-2-pyrrolecarboxylic acid;NSC 40289;N-Methyl-2-pyrrolcarboxylic acid
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CAS No:
1-Methyl-1H-pyrrole-2-carboxylic acid Basic Attributes
125.13
125.13
115703
230-217-8
SBR5D3SAQ7
40289
DTXSID70220031
2933990090
Characteristics
42.2
0.5
Beige to brown-gray Powder
1.2±0.1 g/cm3
135-136 °C
135-137 °C @ Press: 760 Torr
121.1±19.8 °C
1.544
Safety Information
IRRITANT
3
36/37/38
22-24/25-37-26
Xi
Irritant
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:125.13
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:125.047678466
Monoisotopic Mass:125.047678466
Topological Polar Surface Area:42.2
Heavy Atom Count:9
Complexity:124
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Methyl-1H-pyrrole-2-carboxylic acid
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