
No data
No data
No data
| CAS Number | 504-88-1 |
| Catalog Number | AG003JTU(AGN-PC-040KWD) |
| Chemical Name | 3-Nitropropionic Acid |
| EC Number | 208-003-0 |
| IUPAC Name | 3-nitropropanoic acid |
| InChI | InChI=1S/C3H5NO4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6) |
| InChI Key | WBLZUCOIBUDNBV-UHFFFAOYSA-N |
| MDL Number | MFCD00007406 |
| Molecular Formula | C3H5NO4 |
| Molecular Weight | 119.0761 |
| NSC Number | 64266 |
| SMILES | C(CN(=O)=O)C(=O)O |
| UN Number | 2811 |
| UNII | QY4L0FOX0D |
| Synonyms | 3-nitropropanoic acid,
3-nitropropionate,
3-nitropropionic acid,
3-NP acid,
beta-nitropropionic acid,
propionate 3-nitronate,
3-nitropropionic acid,
3-Nitropropanoic acid,
504-88-1,
Bovinocidin,
Hiptagenic acid,
Propanoic acid, 3-nitro-,
beta-Nitropropionic acid,
3-Nitropropionate,
Propionic acid, 3-nitro-,
3-NP acid,
beta-Nitropropanoic acid,
NCI-C03076,
NSC 64266,
NITROPROPIONIC ACID, BETA,
UNII-QY4L0FOX0D,
3-NPA,
beta-Nitropropanoate,
BOVINOCIDIN (3-nitropropionic acid),
CCRIS 454,
HSDB 4147,
3-nitro-propionic acid,
EINECS 208-003-0,
QY4L0FOX0D,
BNP,
.beta.-Nitropropionic acid,
BRN 1759889,
CHEBI:16348,
WBLZUCOIBUDNBV-UHFFFAOYSA-N,
NSC64266,
MFCD00007406,
DSSTox_CID_982,
DSSTox_RID_75904,
3-nitro-1-propionate,
DSSTox_GSID_20982,
CHEMBL451226,
3NP,
CAS-504-88-1,
Nitropropionic aci, beta,
SR-01000076030,
3-nitropropionic-acid,
3-Nitroporpionic Acid,
Spectrum_001674,
3-Nitro-Propanoic acid,
SpecPlus_000692,
Substrate analogue, 20,
AC1L1BZO,
beta -nitropropionic acid,
Spectrum2_000876,
Spectrum3_000993,
Spectrum4_001119,
Spectrum5_001895,
Lopac-N-5636,
WLN: WN2VQ,
AC1Q28KX,
Nitropropionic acid, .beta.,
3-Nitropropionic acid, 8CI,
Lopac0_000838,
SCHEMBL70072,
BSPBio_002685,
KBioGR_001598,
KBioSS_002154,
4-02-00-00771 (Beilstein Handbook Reference),
MLS001066410,
3-Nitropropionic acid, 97%,
DivK1c_006788,
SPECTRUM1504206,
SPBio_000951,
3-NP,
DTXSID1020982,
3-Nitropropionic acid, >=97%,
BDBM82201,
CTK3I9712,
KBio1_001732,
KBio2_002154,
KBio2_004722,
KBio2_007290,
KBio3_001905,
HMS2235N03,
HMS3262H17,
HMS3369D16,
ZINC895862,
Propanoic acid, 3-nitro- (9CI),
BCP15066,
Tox21_202460,
Tox21_303007,
Tox21_500838,
6949AB,
CCG-40325,
NSC-64266,
AKOS006221915,
AKOS015833440,
504-88-1 (FREE ACID),
CM10288,
CS-W013591,
FCH3459604,
HY-W012875,
LP00838,
LS-1311,
RTR-031911,
SDCCGMLS-0066769.P001,
TRA0076505,
KS-0000184K,
3-Nitropropanoic acid; 3-nitropropanoate,
NCGC00015744-01,
NCGC00015744-02,
NCGC00015744-03,
NCGC00015744-04,
NCGC00015744-05,
NCGC00015744-06,
NCGC00015744-07,
NCGC00094169-01,
NCGC00094169-02,
NCGC00094169-03,
NCGC00094169-04,
NCGC00256389-01,
NCGC00260009-01,
NCGC00261523-01,
CC-15785,
SC-89718,
SMR000471863,
DB-008848,
TR-031911,
EU-0100838,
FT-0632243,
C05669,
N 5636,
C-31013,
I14-1898,
SR-01000076030-1,
SR-01000076030-5,
13104-55-7,
3-Nitropropanoate,
propionate 3-nitronate,
C3H5NO4,
3-NITROPROPIONICACID,
CID1678,
C3-H5-N-O4,
AR-1F4683,
NA2811,
UN2811,
B5734,
C015392,
52130-87-7,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 119.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 119.076g/mol |
| Monoisotopic Mass | 119.022g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 83.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
| Symbol: | |
| Hazard Class | 6.1 |
| Hazard statements | H301 |
| Packing Group | Ⅲ |
| Precautionary statements | P301+P310 |
| UN Code | UN 2811 |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
| Test: | Result: |

