AG0032OY

59379-02-1 | 1-Boc-3-pyrrolidinecarbaldehyde

AG0032OY

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CAS Number	59379-02-1
Catalog Number	AG0032OY(AGN-PC-0K6A51)
Chemical Name	1-Boc-3-pyrrolidinecarbaldehyde
IUPAC Name	tert-butyl 3-formylpyrrolidine-1-carboxylate
InChI	InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-5-4-8(6-11)7-12/h7-8H,4-6H2,1-3H3
InChI Key	DWLADVOODHZCFV-UHFFFAOYSA-N
MDL Number	MFCD03791257
Molecular Formula	C10H17NO3
Molecular Weight	199.2469
SMILES	O=CC1CN(C(=O)OC(C)(C)C)CC1
Synonyms	59379-02-1, 1-Boc-3-pyrrolidinecarbaldehyde, Tert-butyl 3-formylpyrrolidine-1-carboxylate, 3-Formyl-pyrrolidine-1-carboxylic acid tert-butyl ester, 1-Boc-Pyrrolidine-3-carboxaldehyde, 1-boc-3-formyl-pyrrolidine, N-BOC-3-PYRROLIDINECARBALDEHYDE, 1-PYRROLIDINECARBOXYLIC ACID, 3-FORMYL-, 1,1-DIMETHYLETHYL ESTER, 3-formylpyrrolidine-1-carboxylic acid tert-butyl ester, AK112807, PubChem11071, AC1NG0EA, 1-Boc-3-formylpyrrolidine, n-boc-3-formyl pyrrolidine, AC1Q1MZ8, SCHEMBL35457, CTK1G9337, N-BOC-3-FORMYLPYRROLIDINE, DWLADVOODHZCFV-UHFFFAOYSA-N, 1-N-Boc-3-pyrrolidinecarbaldehyde, R-1-Boc-3-pyrrolidinecarbaldehyde, ACT09884, BCP15387, KS-00000B0G, ANW-33246, BBL102596, MFCD03791257, RW1016, STL556399, AKOS005258751, AB16193, ACN-036307, CB-3349, CS-W008201, GS-3095, QC-2073, RP25697, SB11619, VP60266, AC-22448, AK-26758, AN-30313, AN-39640, BC202135, BR-26758, K930, SC-19909, SC-54421, SY014495, AB0006955, AB1006697, DB-005683, ST2419940, TR-020603, 4CH-013072, AM20100449, C2170, FT-0080699, FT-0648195, 1-(tert-butyloxycarbonyl)-3-formylpyrrolidine, A-1759, A26498, B50640, 1-(t-butoxycarbonyl)-3-pyrrolidinecarboxaldehyde, MFCD03791257 (95+%), 1-(tert-Butoxycarbonyl)pyrrolidine-3-carbaldehyde, 3-Formyl-pyrrolidine-1-carboxylic acid tert-butyl, 379B021, 1,1-dimethylethyl 3-formyl-1-pyrrolidinecarboxylate, I11-0302, I14-6228, J-504360, 3-formyl-pyrrolidine-1-carboxylic acidtert-butyl ester, 3-Formyl-pyrrolidine-1-carboxylic acid tert-butyl ester, racemic 3-formylpyrrolidine-1-carboxylic acid tert-butyl ester, 3-Formyl-pyrrolidine-1-carboxylic acid tert-butyl ester, AldrichCPR, C10H17NO3, (R)-tert-butyl 3-formylpyrrolidine-1-carboxylate, CID4692112, (S)-tert-butyl 3-formylpyrrolidine-1-carboxylate, tert-butyl (3R)-3-formylpyrrolidine-1-carboxylate, tert-butyl (3S)-3-formylpyrrolidine-1-carboxylate, 191347-94-1, 191348-04-6, 72351-49-6,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.121g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.25g/mol
Monoisotopic Mass	199.121g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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