AG003CL3

73058-30-7 | (S)-2-Benzylaziridine

AG003CL3

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CAS Number	73058-30-7
Catalog Number	AG003CL3(AGN-PC-0OH7SJ)
Chemical Name	(S)-2-Benzylaziridine
IUPAC Name	(2S)-2-benzylaziridine
InChI	InChI=1S/C9H11N/c1-2-4-8(5-3-1)6-9-7-10-9/h1-5,9-10H,6-7H2/t9-/m0/s1
InChI Key	LKQAJXTWYDNYHK-VIFPVBQESA-N
MDL Number	MFCD06796591
Molecular Formula	C9H11N
Molecular Weight	133.1903
SMILES	[C@@H]1(CC2=CC=CC=C2)NC1
Synonyms	(s)-2-benzylaziridine, 73058-30-7, (S)-2-BENZYL-AZIRIDINE, (2S)-2-benzylaziridine, (S)-Benzylaziridine, Aziridine, 2-(phenylmethyl)-, (2S)-, Q-100799, (2R)-2-Benzylaziridine, 2beta-Benzylaziridine, S-2-benzyl aziridine, PubChem20894, SCHEMBL538540, (2S)-2-(phenylmethyl)aziridine, CTK5D7291, DTXSID90453723, LKQAJXTWYDNYHK-VIFPVBQESA-N, ACT01826, BCP18628, ZINC6096624, ANW-44739, FC0759, MFCD06796591, AKOS016842523, Aziridine,2-(phenylmethyl)-, (2S)-, AJ-55817, AN-37399, AS-11452, AB0009986, AX8036092, DB-013664, ST2408310, TX-015709, AM20041087, FT-0655476, M-9049, 058B307, A837704, I01-6730, 2-Benzylaziridine, C9H11N, CB10334, CID11062438, A13297, 77184-95-3,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	133.089g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	133.194g/mol
Monoisotopic Mass	133.089g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	21.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

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