AG008XQO

1065331-03-4 | trans-Methyl methylpyrrolidine-3-carboxylate

AG008XQO

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CAS Number	1065331-03-4
Catalog Number	AG008XQO(AGN-PC-0OW48R)
Chemical Name	trans-Methyl methylpyrrolidine-3-carboxylate
IUPAC Name	methyl (3R,4R)-4-methylpyrrolidine-3-carboxylate
InChI	InChI=1S/C7H13NO2/c1-5-3-8-4-6(5)7(9)10-2/h5-6,8H,3-4H2,1-2H3/t5-,6-/m0/s1
InChI Key	KXYSKSUNLWRSFW-WDSKDSINSA-N
MDL Number	MFCD11845468
Molecular Formula	C7H13NO2
Molecular Weight	143.1836
SMILES	C(=O)(OC)[C@@H]1[C@@H](C)CNC1
Synonyms	(3R,4R)-Methyl 4-methylpyrrolidine-3-carboxylate, 1065331-03-4, methyl (3R,4R)-4-methylpyrrolidine-3-carboxylate, trans-Methyl 4-methylpyrrolidine-3-carboxylate, 1260603-20-0, AC1LTQNO, CTK8C4609, DTXSID90363772, ZINC4202769, ANW-72461, FCH963290, MFCD11845468, AKOS006380828, AJ-48496, DS-13812, AX8162777, TC-161206, (3R,4R)-rel-Methyl 4-methyl-3-pyrrolidinecarboxylate,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	143.095g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.186g/mol
Monoisotopic Mass	143.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

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

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