AG00BCLL

25503-91-7 | 1-Acetylpiperidine-4-carbonitrile

AG00BCLL

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CAS Number	25503-91-7
Catalog Number	AG00BCLL(AGN-PC-0KKKY9)
Chemical Name	1-Acetylpiperidine-4-carbonitrile
IUPAC Name	1-acetylpiperidine-4-carbonitrile
InChI	InChI=1S/C8H12N2O/c1-7(11)10-4-2-8(6-9)3-5-10/h8H,2-5H2,1H3
InChI Key	NFDGRMQIOHRQHF-UHFFFAOYSA-N
MDL Number	MFCD00221055
Molecular Formula	C8H12N2O
Molecular Weight	152.1937
SMILES	N#CC1CCN(C(C)=O)CC1
Synonyms	1-acetylpiperidine-4-carbonitrile, 25503-91-7, 1-ACETYL-4-CYANOPIPERIDINE, 1-acetyl-4-piperidinecarbonitrile, AC1MBT7Z, SCHEMBL6107767, CTK4F5943, DTXSID00373327, NFDGRMQIOHRQHF-UHFFFAOYSA-N, ZINC165539, 4-Piperidinecarbonitrile,1-acetyl-, 1-ethanoylpiperidine-4-carbonitrile, AB1023, MFCD00221055, SBB086863, AKOS006230439, AB04947, GS-0408, ZB008498, DB-015714, FT-0607292, 503A917, A817884, I14-106552, ZINC00165539, CID2756286,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.095g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	152.197g/mol
Monoisotopic Mass	152.095g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code	\N

Certificate of Analysis

Lot Number