AG00D82K

476493-40-0 | 1-N-Boc-3-Cyanopyrrolidine

AG00D82K

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CAS Number	476493-40-0
Catalog Number	AG00D82K(AGN-PC-0KKLAQ)
Chemical Name	1-N-Boc-3-Cyanopyrrolidine
IUPAC Name	tert-butyl 3-cyanopyrrolidine-1-carboxylate
InChI	InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)12-5-4-8(6-11)7-12/h8H,4-5,7H2,1-3H3
InChI Key	VDDMCMFPUSCJNA-UHFFFAOYSA-N
MDL Number	MFCD03001709
Molecular Formula	C10H16N2O2
Molecular Weight	196.2462
SMILES	CC(C)(C)OC(=O)N1CCC(C1)C#N
Synonyms	476493-40-0, 1-N-Boc-3-Cyanopyrrolidine, tert-butyl 3-cyanopyrrolidine-1-carboxylate, n-boc-3-cyanopyrrolidine, 1-boc-3-cyanopyrrolidine, 1-boc-3-cyano-pyrrolidine, 1-N-Boc-3-Cyano-pyrrolidine, 3-Cyano-pyrrolidine-1-carboxylic acid tert-butyl ester, (S)-tert-butyl 3-cyanopyrrolidine-1-carboxylate, AK-27252, Q-102877, MFCD03001709, 1-PYRROLIDINECARBOXYLIC ACID, 3-CYANO-, 1,1-DIMETHYLETHYL ESTER, (r)-1-n-boc-3-cyanopyrrolidine, AK-30239, AK-30413, AC1MBUDA, PubChem11145, ACMC-20aa7b, AC1Q1MYZ, ACMC-20a13s, AC1Q1MZ0, AC1Q1MZ1, SCHEMBL56905, KSC495Q7N, CTK3J5876, DTXSID30373537, VDDMCMFPUSCJNA-UHFFFAOYSA-N, HT450, ACT03452, BCP15390, CS-D0751, ANW-30548, BBL100743, CT0158, FCH919466, STL554537, AKOS005255580, AC-9198, ACN-036310, AN-7260, CB-1105, DS-0590, MCULE-3816659901, PB23316, RP04046, RTC-063251, TRA0012621, TRA0086542, VP60020, VP60021, VP60207, KS-0000023Q, tert-butyl 3-cyanopyrrolidinecarboxylate, BC215504, BR-27252, CC-04883, SC-12008, SY029001, (r,s)-1-n-boc-pyrrolidine-3-carbonitrile, 1-(t-butyloxycarbonyl)-3-cyanopyrrolidine, AB0006568, AX8012325, DB-011337, TC-063251, 4CH-007180, 4CH-013260, AM20100190, FT-0644720, ST50825399, W6431, EN300-68721, MFCD03001709 (95%), B-1553, B66770, 493B400, C-08974, I14-1519, 3-cyanopyrrolidine-1-carboxylic acid tert-butyl ester, 4-cyano-pyrrolidine-1-carboxylic acid tert-butyl ester, Z1741960882, 1,1-DIMETHYLETHYL 3-CYANO-1-PYRROLIDINECARBOXYLATE, 3-CYANO-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL E, 476493-40-0 tert-butyl 3-cyanopyrrolidine-1-carboxylate, (R)-1-Boc-3-cyanopyrrolidine, (S)-1-Boc-3-cyanopyrrolidine, C10H16N2O2, (S)-1-N-Boc-3-cyano-pyrrolidine, ZINC02549346, (R)-tert-butyl 3-cyanopyrrolidine-1-carboxylate, 132945-78-9, CID2756787, 132945-76-7, (S)-1-N-BOC-3-CYANOPYRROLIDINE, A2818, A7290, A12694, tert-butyl (3S)-3-cyanopyrrolidine-1-carboxylate, 1187930-86-4,

Complexity	272
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.121g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	196.25g/mol
Monoisotopic Mass	196.121g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

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