AG000TMY

Name: 3-(1H-Pyrrol-1-yl)benzaldehyde
Brand: Angene Chemical
SKU: AG000TMY

129747-77-9 | 3-(1H-Pyrrol-1-yl)benzaldehyde

AG000TMY

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CAS Number	129747-77-9
Catalog Number	AG000TMY(AGN-PC-0KKXLH)
Chemical Name	3-(1H-Pyrrol-1-yl)benzaldehyde
IUPAC Name	3-pyrrol-1-ylbenzaldehyde
InChI	InChI=1S/C11H9NO/c13-9-10-4-3-5-11(8-10)12-6-1-2-7-12/h1-9H
InChI Key	PALTUANHIBXQMX-UHFFFAOYSA-N
MDL Number	MFCD03086140
Molecular Formula	C11H9NO
Molecular Weight	171.1953
SMILES	O=CC2(=CC(N1(C=CC=C1))=CC=C2)
Synonyms	3-(1H-Pyrrol-1-yl)benzaldehyde, 129747-77-9, 3-pyrrol-1-ylbenzaldehyde, Benzaldehyde, 3-(1H-pyrrol-1-yl)-, 3-Pyrrol-1-yl-benzaldehyde, Benzaldehyde,3-(1H-pyrrol-1-yl)-, ACMC-20airb, 3-pyrrolylbenzaldehyde, AC1MCR1C, 3-(1-pyrrolyl)benzaldehyde, 3-(pyrrol-1-yl)benzaldehyde, SCHEMBL4024285, CTK4B6391, DTXSID20380159, PALTUANHIBXQMX-UHFFFAOYSA-N, ZINC158958, ANW-75237, MFCD03086140, SBB088507, AKOS006228829, PS-4300, RP02662, RTC-069685, TRA0004305, VZ25920, KS-00002A59, AJ-15424, AN-32386, ZB007154, TC-069685, 4CH-004196, FT-0613496, Y7377, 3-(1H-Pyrrol-1-yl)benzaldehyde, AldrichCPR, A25692, K-4033, 747P779, I14-13104, C11H9NO, 3-(1-pyrrolidinyl)benzaldehyde, ZINC00158958, CID2776528,

Complexity	175
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.068g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	171.199g/mol
Monoisotopic Mass	171.068g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	22A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited