AG00D9G4

52703-80-7 | Azepan-1-yl-acetic acid

AG00D9G4

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CAS Number	52703-80-7
Catalog Number	AG00D9G4(AGN-PC-0KPXVT)
Chemical Name	Azepan-1-yl-acetic acid
IUPAC Name	2-(azepan-1-yl)acetic acid
InChI	InChI=1S/C8H15NO2/c10-8(11)7-9-5-3-1-2-4-6-9/h1-7H2,(H,10,11)
InChI Key	VVKHVWUCJZPGJH-UHFFFAOYSA-N
MDL Number	MFCD00462826
Molecular Formula	C8H15NO2
Molecular Weight	157.2102
SMILES	O=C(O)CN1CCCCCC1
Synonyms	azepan-1-ylacetic acid, 52703-80-7, Azepan-1-yl-acetic acid, 2-(azepan-1-yl)acetic acid, 1-azepanylacetic acid, 2-azaperhydroepinylacetic acid, F1981-0007, AC1MKHJP, BAS 08233080, SCHEMBL5499056, CTK1G8218, DTXSID90390109, SP368, ALBB-000110, ZINC3881157, Azepan-1-ylacetic acid, AldrichCPR, BBL012438, MFCD00462826, SBB010389, STK392512, AKOS000113610, MCULE-1178025352, AJ-46622, DA-18587, AB0154317, TR-018680, BB 0219159, FT-0678702, ST50160287, W-7076, AO-365/33953043, I04-5420, AZEPAN-1-YL-ACETICACID, CID3157319, 2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethanamine,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.11g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.213g/mol
Monoisotopic Mass	157.11g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H412
Packing Group
Precautionary statements	P273-P501
UN Code

Certificate of Analysis

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