Cas no 84497-69-8 (1H-Pyrrole-2-carboxaldehyde,1-(3-hydroxypropyl)-)
84497-69-8 structure
Product Name:1H-Pyrrole-2-carboxaldehyde,1-(3-hydroxypropyl)-
CAS No:84497-69-8
MF:C8H11NO2
MW:153.178442239761
CID:707305
PubChem ID:20246949
Update Time:2025-04-19
1H-Pyrrole-2-carboxaldehyde,1-(3-hydroxypropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole-2-carboxaldehyde,1-(3-hydroxypropyl)-
- 1H-Pyrrole-2-carboxaldehyde, 1-(3-hydroxypropyl)- (9CI)
- 1-(3-Hydroxypropyl)-1H-pyrrole-2-carbaldehyde
- XMNCMVSLANZVCD-UHFFFAOYSA-N
- SCHEMBL10852053
- AKOS014315868
- 1-(3-hydroxypropyl)-2-formylpyrrole
- 84497-69-8
-
- Inchi： 1S/C8H11NO2/c10-6-2-5-9-4-1-3-8(9)7-11/h1,3-4,7,10H,2,5-6H2
- InChI Key： XMNCMVSLANZVCD-UHFFFAOYSA-N
- SMILES： OCCCN1C=CC=C1C=O
Computed Properties
- Exact Mass: 153.079
- Monoisotopic Mass: 153.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 42.2A^2
- XLogP3: 0.1
1H-Pyrrole-2-carboxaldehyde,1-(3-hydroxypropyl)- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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